Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 2Ingredient: 1Target: 1Links: 4
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 34868
- Core Entity Id
- 41943
- Source Entity Count
- 1
- Preferred Name
- Tenuifoliside d
- Name En
- Pubchem Id
- 5321809
- Smiles Canonical
- COC1=CC(=CC(=C1OC)OC)C=CC(=O)OCC2C(C(C(CO2)O)O)O
- Molecular Formula
- C18H24O9
- Molecular Weight
- 384.3810
- Inchikey
- AMEZBGPRIRXFEL-FLYJURCFSA-N
- Inchi
- InChI=1S/C18H24O9/c1-23-12-6-10(7-13(24-2)18(12)25-3)4-5-15(20)27-9-14-17(22)16(21)11(19)8-26-14/h4-7,11,14,16-17,19,21-22H,8-9H2,1-3H3/b5-4+/t11-,14+,16+,17+/m0/s1
- Isomeric Smiles
- COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H](CO2)O)O)O
- Cas Id
- 139726-38-8
- Ob Score
- Mol Logp
- -0.2497
- Num H Donors
- 3
- Num H Acceptors
- 9
- Num Rotatable Bonds
- 7
- Drug Likeness
- 0.4310
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Tenuifoliside D
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Tenuifoliside D
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Tenuifoliside D
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Tenuifoliside D
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Tenuifoliside d
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Tenuifoliside d
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
YUAN ZHI
Role
TCM_name
Source
TCMBank
Preferred
No
Name
YUAN ZHI
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Thinleaf Milkwort
Role
TCM_name_en
Source
TCMBank
Preferred
No
Name
((2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl)methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Role
alias
Source
itcmdb_public
Preferred
No
Name
139726-38-8
Role
alias
Source
HERB_v2
Preferred
No
Name
139726-38-8
Role
alias
Source
itcmdb_public
Preferred
No
Name
D-Glucitol, 1,5-anhydro-, 6-((2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoate)
Role
alias
Source
HERB_v2
Preferred
No
Name
D-Glucitol, 1,5-anhydro-, 6-(3-(3,4,5-trimethoxyphenyl)-2-propenoate), (E)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
D-Glucitol, 1,5-anhydro-, 6-(3-(3,4,5-trimethoxyphenyl)-2-propenoate), (E)-
Role
alias
Source
HERB_v2
Preferred
No
Name
D-Glucitol, 1,5-anhydro-, 6-[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoate]
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXSID201145920
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID201145920
Role
alias
Source
itcmdb_public
Preferred
No
Name
GQ54JB5XIT
Role
alias
Source
itcmdb_public
Preferred
No
Name
GQ54JB5XIT
Role
alias
Source
HERB_v2
Preferred
No
Name
UNII-GQ54JB5XIT
Role
alias
Source
itcmdb_public
Preferred
No
Name
UNII-GQ54JB5XIT
Role
alias
Source
HERB_v2
Preferred
No
Name
[(2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Role
alias
Source
HERB_v2
Preferred
No
Aliases
Additional names normalized into the restored final schema.
YUAN ZHIThinleaf Milkwort((2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl)methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate139726-38-8D-Glucitol, 1,5-anhydro-, 6-((2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoate)D-Glucitol, 1,5-anhydro-, 6-(3-(3,4,5-trimethoxyphenyl)-2-propenoate), (E)-D-Glucitol, 1,5-anhydro-, 6-[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoate]DTXSID201145920GQ54JB5XITUNII-GQ54JB5XIT[(2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Cross References
Trusted external identifiers retained for this final record.
Cas
139726-38-8
Herb
HBIN045919
Npass
NPC26917
Tcmid
20942
Sym Map
SMIT27071
Tcm Id
577
Pub Chem
5321809
Tcmbank
TCMBANKIN041501
Etcm Ingredient
Tenuifoliside D
Itcmdb Generated
ITX-INGREDIENT-7C061B9777E6ITX-INGREDIENT-A389250282F7
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C18H24O9/c1-23-12-6-10(7-13(24-2)18(12)25-3)4-5-15(20)27-9-14-17(22)16(21)11(19)8-26-14/h4-7,11,14,16-17,19,21-22H,8-9H2,1-3H3/b5-4+/t11-,14+,16+,17+/m0/s1
Mol Wt
384.381
Cas Id
139726-38-8
Mol Log P
-0.2497000000000003
Version
v2
In Ch Ikey
AMEZBGPRIRXFEL-FLYJURCFSA-N
Suppress
0
Tcm Name
YUAN ZHI
Tcm Name2
YUAN ZHI
Mol2 Path
/TCM_database/2007_3d_all/20958.mol2
Reference
660, 2184
Num Hdonors
3
Tcm Name En
Thinleaf Milkwort
Drug Likeness
0.431
Num Hacceptors
9
Isomeric Smiles
COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H](CO2)O)O)O
Canonical Smiles
COC1=CC(=CC(=C1OC)OC)C=CC(=O)OCC2C(C(C(CO2)O)O)O
Herb Alias Names
UNII-GQ54JB5XITGQ54JB5XIT139726-38-8D-Glucitol, 1,5-anhydro-, 6-((2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoate)D-Glucitol, 1,5-anhydro-, 6-(3-(3,4,5-trimethoxyphenyl)-2-propenoate), (E)-D-Glucitol, 1,5-anhydro-, 6-[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoate][(2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate((2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl)methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoateDTXSID201145920
Molecular Weight
384.140
Molecular Weight
384.38
Molecular Formula
C18H24O9
Molecular Formula
C18H24O9
Num Rotatable Bonds
7
Fda Maximum Daily Dose (Fdamdd)
0.024
Quantitative Estimate Of Drug Likeness（Qed）
0.431