IngredientID 20185

Ginsenoside-rc

C53H90O22

Relationship Network

Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.

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Experiment: 1Herb: 12Ingredient: 1Reference: 1Target: 4Links: 18

Arranging relationship network...

Record Fields

Scalar fields from the final ingredient record.

Ingredient Id: 20185
Core Entity Id: 25615
Source Entity Count: 1
Preferred Name: Ginsenoside-rc
Name En
Pubchem Id: 100018
Smiles Canonical: C1([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])(C([H])([H])[C@@]([H])(O[H])[C@]([H])([C@@]([H])([C@@](C([H])([H])[H])(O[C@@]([H])([C@]([H])(O[H])[C@@]([H])(O[H])[C@]2([H])O[H])O[C@]2([H])C([H]) ([H])O[C@@]3([H])OC([H])([H])[C@]([H])(O[H])[C@]([H])(O[H])[C@@]3([H])O[H])C([H])([H])C([H])([H])\C([H])=C(/C([H])([H])[H])\C([H])([H])[H])C([H])([H])C4([H])[H])[C@@]45C([H])([H])[H])[C@@]5(C([H])([H] )[H])C([H])([H])C6([H])[H])[C@@]6([H])C(C([H])([H])[H])(C([H])([H])[H])[C@@]1([H])O[C@@]([H])(O[C@@]([H])(C([H])([H])O[H])[C@]([H])(O[H])[C@@]7([H])O[H])[C@@]7([H])O[C@@]([H])(O[C@@]([H])(C([H])([H])O [H])[C@]([H])(O[H])[C@@]8([H])O[H])[C@@]8([H])O[H]
Molecular Formula: C53H90O22
Molecular Weight: 1079.2810
Inchikey: JDCPEKQWFDWQLI-LUQKBWBOSA-N
Inchi: InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28-,29+,30-,31+,32-,33-,34+,35+,36-,37+,38-,39-,40-,41+,42+,43+,44+,45+,46-,47-,48-,50-,51+,52+,53-/m0/s1
Isomeric Smiles: CC(=CCC[C@@](C)([C@H]1CC[C@@]2([C@@H]1[C@@H](C[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)C)O)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H](O8)CO)O)O)O)O)O)C
Cas Id: 11021-14-0
Ob Score: 8.1259
Mol Logp: -1.5635
Num H Donors: 14
Num H Acceptors: 22
Num Rotatable Bonds: 16
Drug Likeness: 0.0610
Polar Surface Area: 357.0000
Molecular Volume: 719.0000
Alogp: -1.0000

Names

Preferred names, aliases, and source labels retained in the final schema.

Name

Ginsenoside Rc

Role

preferred

Source

ETCM_v2

Preferred

Yes

Name

Ginsenoside rc

Role

preferred

Source

itcmdb_public

Preferred

Yes

Name

Ginsenoside-Rc

Role

preferred

Source

SymMap_v2

Preferred

Yes

Name

Ginsenoside-rc

Role

preferred

Source

HERB_v2

Preferred

Yes

Name

ginsenoside-Rc

Role

preferred

Source

TCMBank

Preferred

Yes

Name

人参;三七;西洋参

Role

TCM_name

Source

TCMBank

Preferred

Name

竹节蔘

Role

TCM_name

Source

TCMBank

Preferred

Name

黄精

Role

TCM_name

Source

TCMBank

Preferred

Name

Panax japonicus

Role

TCM_name2

Source

TCMBank

Preferred

Name

REN SHEN;SAN QI;XI YANG SHEN

Role

TCM_name2

Source

TCMBank

Preferred

Name

Ginseng;Sanchi;American Ginseng

Role

TCM_name_en

Source

TCMBank

Preferred

Name

Panax japonicus C. A. Mey.

Role

TCM_name_en

Source

TCMBank

Preferred

Name

Solomonseal Rhizome

Role

TCM_name_en

Source

TCMBank

Preferred

Name

0K83B0L786

Role

alias

Source

itcmdb_public

Preferred

Name

0K83B0L786

Role

alias

Source

HERB_v2

Preferred

Name

11021-14-0

Role

alias

Source

TCMBank

Preferred

Name

11021-14-0

Role

alias

Source

HERB_v2

Preferred

Name

11021-14-0

Role

alias

Source

itcmdb_public

Preferred

Name

12-hydroxy-20-[(6-o-pentofuranosylhexopyranosyl)oxy]dammar-24-en-3-yl 2-o-hexopyranosylhexopyranoside

Role

alias

Source

TCMBank

Preferred

Name

2-(hydroxymethyl)-6-[6-(hydroxymethyl)-2-[[17-[2-[6-[[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methyl-hept-5-en-2-yl]-4,4,10,14-tetramethyl-12-oxidanyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocy

Role

alias

Source

TCMBank

Preferred

Name

2-[(2-{[1-(2-{[6-({[3,4-DIHYDROXY-5-(HYDROXYMETHYL)OXOLAN-2-YL]OXY}METHYL)-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}-6-METHYLHEPT-5-EN-2-YL)-11-HYDROXY-3A,3B,6,6,9A-PENTAMETHYL-DODECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-7-YL]OXY}-4,5-DIHYDROXY-6-(HYDROXYMETHYL)OXAN-3-YL)OXY]-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL

Role

alias

Source

TCMBank

Preferred

Name

2-[(2-{[14-(2-{[6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl)-16-hydroxy-2,6,6,10,11-pentamethyltetracyclo[8.7.0.0

Role

alias

Source

TCMBank

Preferred

Name

2-[2-[[17-[2-[6-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Role

alias

Source

TCMBank

Preferred

Name

2-[[2-[[17-[2-[[6-[[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]oxymethyl]-3,4,5-trihydroxy-2-oxanyl]oxy]-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,10,14-tetramethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydr

Role

alias

Source

TCMBank

Preferred

Name

20-((6-O-alpha-L-Arabinofuranosyl-beta-D-glucopyranosyl)oxy)-12beta-hydroxydammar-24-en-3beta-yl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranoside

Role

alias

Source

TCMBank

Preferred

Name

A802167

Role

alias

Source

TCMBank

Preferred

Name

AC1L2NV3

Role

alias

Source

TCMBank

Preferred

Name

AC1Q70KB

Role

alias

Source

TCMBank

Preferred

Name

AKOS026750610

Role

alias

Source

TCMBank

Preferred

Name

BRD-A65550283-001-01-9

Role

alias

Source

TCMBank

Preferred

Name

BRN 1677618

Role

alias

Source

TCMBank

Preferred

Name

CHEBI:77154

Role

alias

Source

itcmdb_public

Preferred

Name

CHEBI:77154

Role

alias

Source

HERB_v2

Preferred

Name

CHEBI:91809

Role

alias

Source

TCMBank

Preferred

Name

EINECS 234-253-5

Role

alias

Source

TCMBank

Preferred

Name

EINECS 234-253-5

Role

alias

Source

itcmdb_public

Preferred

Name

EINECS 234-253-5

Role

alias

Source

HERB_v2

Preferred

Name

FT-0626702

Role

alias

Source

TCMBank

Preferred

Name

Ginsenoside Rc

Role

alias

Source

itcmdb_public

Preferred

Name

Ginsenoside-Rc from Panax ginseng (Korean ginseng) root

Role

alias

Source

TCMBank

Preferred

Name

Ginsenoside-Rc from Panax ginseng (Korean ginseng) root, triterpenoid saponin, >=98% (HPLC)

Role

alias

Source

TCMBank

Preferred

Name

I06-0733

Role

alias

Source

TCMBank

Preferred

Name

LS-71253

Role

alias

Source

TCMBank

Preferred

Name

MFCD00133368

Role

alias

Source

HERB_v2

Preferred

Name

MFCD00133368

Role

alias

Source

itcmdb_public

Preferred

Name

NSC 310104

Role

alias

Source

HERB_v2

Preferred

Name

NSC 310104

Role

alias

Source

itcmdb_public

Preferred

Name

NSC-310104

Role

alias

Source

TCMBank

Preferred

Name

Panax bipinnatifidum Seem.

Role

alias

Source

TCMBank

Preferred

Name

Panaxoside RC

Role

alias

Source

HERB_v2

Preferred

Name

Panaxoside RC

Role

alias

Source

TCMBank

Preferred

Name

Panaxoside RC

Role

alias

Source

itcmdb_public

Preferred

Name

SMP2_000126

Role

alias

Source

TCMBank

Preferred

Name

UNII-0K83B0L786

Role

alias

Source

itcmdb_public

Preferred

Name

UNII-0K83B0L786

Role

alias

Source

HERB_v2

Preferred

Name

ginsenoside Rc

Role

alias

Source

TCMBank

Preferred

Name

ginsenoside-Rc

Role

alias

Source

HERB_v2

Preferred

Name

{11,15}]heptadecan-5-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Role

alias

Source

TCMBank

Preferred

Name

{2,7}.0

Role

alias

Source

TCMBank

Preferred

Name

珠子蔘

Role

alias

Source

TCMBank

Preferred

Name

13.补虚药(60-62)

Role

level1_name

Source

TCMBank

Preferred

Name

tonifying and replenishing medicinal

Role

level1_name_en

Source

TCMBank

Preferred

Name

1.补气药(15-15)

Role

level2_name

Source

TCMBank

Preferred

Name

4.补阴药(17-17)

Role

level2_name

Source

TCMBank

Preferred

Name

qi-tonifying medicinal

Role

level2_name_en

Source

TCMBank

Preferred

Name

yin-tonifying medicinal

Role

level2_name_en

Source

TCMBank

Preferred

Aliases

Additional names normalized into the restored final schema.

Ginsenoside Rc人参;三七;西洋参竹节蔘黄精Panax japonicusREN SHEN;SAN QI;XI YANG SHENGinseng;Sanchi;American GinsengPanax japonicus C. A. Mey.Solomonseal Rhizome0K83B0L78611021-14-012-hydroxy-20-[(6-o-pentofuranosylhexopyranosyl)oxy]dammar-24-en-3-yl 2-o-hexopyranosylhexopyranoside2-(hydroxymethyl)-6-[6-(hydroxymethyl)-2-[[17-[2-[6-[[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methyl-hept-5-en-2-yl]-4,4,10,14-tetramethyl-12-oxidanyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocy2-[(2-{[1-(2-{[6-({[3,4-DIHYDROXY-5-(HYDROXYMETHYL)OXOLAN-2-YL]OXY}METHYL)-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}-6-METHYLHEPT-5-EN-2-YL)-11-HYDROXY-3A,3B,6,6,9A-PENTAMETHYL-DODECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-7-YL]OXY}-4,5-DIHYDROXY-6-(HYDROXYMETHYL)OXAN-3-YL)OXY]-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL2-[(2-{[14-(2-{[6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl)-16-hydroxy-2,6,6,10,11-pentamethyltetracyclo[8.7.0.02-[2-[[17-[2-[6-[[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol2-[[2-[[17-[2-[[6-[[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]oxymethyl]-3,4,5-trihydroxy-2-oxanyl]oxy]-6-methylhept-5-en-2-yl]-12-hydroxy-4,4,10,14-tetramethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4,5-dihydr20-((6-O-alpha-L-Arabinofuranosyl-beta-D-glucopyranosyl)oxy)-12beta-hydroxydammar-24-en-3beta-yl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranosideA802167AC1L2NV3AC1Q70KBAKOS026750610BRD-A65550283-001-01-9BRN 1677618CHEBI:77154CHEBI:91809EINECS 234-253-5FT-0626702Ginsenoside-Rc from Panax ginseng (Korean ginseng) rootGinsenoside-Rc from Panax ginseng (Korean ginseng) root, triterpenoid saponin, >=98% (HPLC)I06-0733LS-71253MFCD00133368NSC 310104NSC-310104Panax bipinnatifidum Seem.Panaxoside RCSMP2_000126UNII-0K83B0L786{11,15}]heptadecan-5-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol{2,7}.0珠子蔘13.补虚药(60-62)tonifying and replenishing medicinal1.补气药(15-15)4.补阴药(17-17)qi-tonifying medicinalyin-tonifying medicinal

Cross References

Trusted external identifiers retained for this final record.

Cas

11021-14-0

Herb

HBIN027737HBIN027738

Npass

NPC284932

Tcmid

23181257148425

Tcmsp

MOL005336MOL006746MOL007479MOL011397

Sym Map

SMIT00269SMIT02571SMIT07112SMIT08314SMIT18948

Tcm Id

147391544019110191114028

Pub Chem

1000181285588913239905713474047944181925

Tcmbank

TCMBANKIN040444TCMBANKIN047773TCMBANKIN051289TCMBANKIN051814

Etcm Ingredient

Ginsenoside Rcginsenoside- Rc

Itcmdb Generated

ITX-INGREDIENT-27550CE3C433ITX-INGREDIENT-370EF87C9A81ITX-INGREDIENT-71CFFD4EBBFEITX-INGREDIENT-721A6BABC8F4

Attributes

Merged source attributes and domain-specific metadata.

Alog P

-1

In Ch I

InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28-,29+,30-,31+,32-,33-,34+,35+,36-,37+,38-,39-,40-,41+,42+,43+,44+,45+,46-,47-,48-,50-,51+,52+,53-/m0/s1

Mol Wt

1079.281000000001

Cas Id

11021-14-0

Smiles

C1([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])(C([H])([H])[C@@]([H])(O[H])[C@]([H])([C@@]([H])([C@@](C([H])([H])[H])(O[C@@]([H])([C@]([H])(O[H])[C@@]([H])(O[H])[C@]2([H])O[H])O[C@]2([H])C([H]) ([H])O[C@@]3([H])OC([H])([H])[C@]([H])(O[H])[C@]([H])(O[H])[C@@]3([H])O[H])C([H])([H])C([H])([H])\C([H])=C(/C([H])([H])[H])\C([H])([H])[H])C([H])([H])C4([H])[H])[C@@]45C([H])([H])[H])[C@@]5(C([H])([H] )[H])C([H])([H])C6([H])[H])[C@@]6([H])C(C([H])([H])[H])(C([H])([H])[H])[C@@]1([H])O[C@@]([H])(O[C@@]([H])(C([H])([H])O[H])[C@]([H])(O[H])[C@@]7([H])O[H])[C@@]7([H])O[C@@]([H])(O[C@@]([H])(C([H])([H])O [H])[C@]([H])(O[H])[C@@]8([H])O[H])[C@@]8([H])O[H]C1([H])([H])C([H])([H])[C@](C([H])([H])[H])([C@@]([H])(C([H])([H])[C@@]([H])(O[H])[C@]([H])([C@@]([H])([C@](O[C@]([H])(O[C@]([H])(C([H])([H])O[C@]2([H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]([H])(C([H])( [H])O[H])O2)[C@@]([H])(O[H])[C@]3([H])O[H])[C@]3([H])O[H])(C([H])([H])[H])C([H])([H])C([H])([H])\C([H])=C(/C([H])([H])[H])\C([H])([H])[H])C([H])([H])C4([H])[H])[C@@]45C([H])([H])[H])[C@@]5(C([H])([H]) [H])C([H])([H])C6([H])[H])[C@]6([H])C(C([H])([H])[H])(C([H])([H])[H])[C@@]1([H])O[C@]([H])(O[C@]([H])(C([H])([H])O[H])[C@@]([H])(O[H])[C@]7([H])O[H])[C@]7([H])O[C@]([H])(O[C@]([H])(C([H])([H])O[H])[C@ @]([H])(O[H])[C@]8([H])O[H])[C@]8([H])O[H]CC(=CCCC(C)(C1CCC2(C1C(CC3C2CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)O)C)OC7C(C(C(C(O7)COC8C(C(C(O8)CO)O)O)O)O)O)C[C@]1([H])([C@](O[C@]2([H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]([H])(C([H])([H])O[C@@]3([H])O[C@]([H])(C([H])([H])O[H])[C@]([H])(O[H])[C@@]3([H])O[H])O2)(C([H])([H])[H])C([H])([H])C([H] )([H])\C([H])=C(/C([H])([H])[H])\C([H])([H])[H])[C@@]([H])([C@@]([H])(C([H])([H])[C@]4([H])[C@@]5(C([H])([H])[H])C([H])([H])C([H])([H])[C@]6([H])[C@]4(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]([H])(O [C@@]7([H])O[C@@]([H])(C([H])([H])O[H])[C@@]([H])(O[C@]8([H])O[C@]([H])(C([H])([H])O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]8([H])O[H])[C@@]([H])(O[H])[C@]7([H])O[H])C6(C([H])([H])[H])C([H])([H])[H])O [H])[C@@]5([H])C([H])([H])C1([H])[H]

37 Flag

C Count

5253

Mol Log P

-1.563499999999986

N Count

O Count

P Count

S Count

Version

v1,v2

In Ch Ikey

JDCPEKQWFDWQLI-LUQKBWBOSA-N

Ob Score

8.125853728.1258548.1268.1598.1593018518.159302

Suppress

Tcm Name

人参;三七;西洋参竹节蔘黄精

Tcm Name2

Panax japonicusREN SHEN;SAN QI;XI YANG SHEN

Mol2 Path

/TCM_database/13.补虚药(60-62)/1.补气药(15-15)/竹节蔘/structure/2D,3D/3D/Ginsenoside Rc.mol2/TCM_database/13.补虚药(60-62)/4.补阴药(17-17)/黄精/structure/ginsenoside-Rc.mol2/TCM_database/2003_3d_all/3367.mol2/TCM_database/2007_3d_all/08426.mol2

Reference

4, 9004, 900, 4647, 4702, 5508

Num Hdonors

Tcm Name En

Ginseng;Sanchi;American GinsengPanax japonicus C. A. Mey.Solomonseal Rhizome

Level1 Name

13.补虚药(60-62)

Level2 Name

1.补气药(15-15)4.补阴药(17-17)

Num H Donors

Drug Likeness

0.061

Num Hacceptors

Level1 Name En

tonifying and replenishing medicinal

Level2 Name En

qi-tonifying medicinalyin-tonifying medicinal

Isomeric Smiles

CC(=CCC[C@@](C)([C@H]1CC[C@@]2([C@@H]1[C@@H](C[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)C)O)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO[C@H]8[C@@H]([C@H]([C@@H](O8)CO)O)O)O)O)O)C

Molecule Weight

1079.27|1079.431079.43

Num H Acceptors

Canonical Smiles

CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)O)C)OC7C(C(C(C(O7)COC8C(C(C(O8)CO)O)O)O)O)O)C

Herb Alias Names

11021-14-0Panaxoside RCginsenoside-RcNSC 310104UNII-0K83B0L786CHEBI:77154EINECS 234-253-5MFCD001333680K83B0L786

Molecular Weight

1078.590

Molecular Volume

719734736

Molecular Weight

106510791079.27

Molecule Formula

C53H90O22|c53h90o22

Molecular Formula

C53H90O22

Molecular Formula

C52H88O22C53H90O22

Molecular Formula

C53H90O22

Num Rotatable Bonds

Link Ingredient Id

269.07112.0

Num Rotatable Bonds

1516

Molecular Polar Surface Area

357

Fda Maximum Daily Dose (Fdamdd)

0.0020.013

Quantitative Estimate Of Drug Likeness（Qed）

0.061