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: 1Ingredient: 1Target: 6Links: 7
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 24164
- Core Entity Id
- 30044
- Source Entity Count
- 1
- Preferred Name
- Lanost-8-en-3beta-ol
- Name En
- Pubchem Id
- 440560
- Smiles Canonical
- CC(C)CCCC(C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C
- Molecular Formula
- C30H52O
- Molecular Weight
- 428.7450
- Inchikey
- MBZYKEVPFYHDOH-BQNIITSRSA-N
- Inchi
- InChI=1S/C30H52O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h20-22,25-26,31H,9-19H2,1-8H3/t21-,22-,25+,26+,28-,29-,30+/m1/s1
- Isomeric Smiles
- C[C@H](CCCC(C)C)[C@H]1CC[C@@]2([C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C
- Cas Id
- 79-62-9
- Ob Score
- 34.2260
- Mol Logp
- 8.5590
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 5
- Drug Likeness
- 0.4350
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Lanost-8-En-3Beta-Ol
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Lanost-8-En-3Beta-Ol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Lanost-8-en-3beta-ol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Lanost-8-en-3beta-ol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
lanost-8-en-3beta-ol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
lanost-8-en-3beta-ol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
(3S,5R,10S,13R,14R,17R)-17-[(1R)-1,5-dimethylhexyl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Role
alias
Source
TCMBank
Preferred
No
Name
(3S,5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Role
alias
Source
TCMBank
Preferred
No
Name
24,25-Dihydrolanosterol
Role
alias
Source
itcmdb_public
Preferred
No
Name
24,25-Dihydrolanosterol
Role
alias
Source
HERB_v2
Preferred
No
Name
24,25-Dihydrolanosterol
Role
alias
Source
TCMBank
Preferred
No
Name
24-dihydrolanosterol
Role
alias
Source
itcmdb_public
Preferred
No
Name
24-dihydrolanosterol
Role
alias
Source
HERB_v2
Preferred
No
Name
3beta-Hydroxylanost-8-ene
Role
alias
Source
HERB_v2
Preferred
No
Name
3beta-Hydroxylanost-8-ene
Role
alias
Source
itcmdb_public
Preferred
No
Name
5alpha-Lanost-8-en-3beta-ol
Role
alias
Source
HERB_v2
Preferred
No
Name
5alpha-Lanost-8-en-3beta-ol
Role
alias
Source
itcmdb_public
Preferred
No
Name
79-62-9
Role
alias
Source
HERB_v2
Preferred
No
Name
79-62-9
Role
alias
Source
itcmdb_public
Preferred
No
Name
C05109
Role
alias
Source
TCMBank
Preferred
No
Name
CHEBI:28113
Role
alias
Source
TCMBank
Preferred
No
Name
Dihydrolanosterin
Role
alias
Source
itcmdb_public
Preferred
No
Name
Dihydrolanosterin
Role
alias
Source
HERB_v2
Preferred
No
Name
Dihydrolanosterol
Role
alias
Source
itcmdb_public
Preferred
No
Name
Dihydrolanosterol
Role
alias
Source
HERB_v2
Preferred
No
Name
LMST01010087
Role
alias
Source
TCMBank
Preferred
No
Name
Lanost-8-en-3-ol, (3.beta.)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Lanost-8-en-3-ol, (3.beta.)-
Role
alias
Source
HERB_v2
Preferred
No
Name
Lanostenol
Role
alias
Source
HERB_v2
Preferred
No
Name
Lanostenol
Role
alias
Source
itcmdb_public
Preferred
No
Name
Lanosterol, dihydro-
Role
alias
Source
HERB_v2
Preferred
No
Name
Lanosterol, dihydro-
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
(3S,5R,10S,13R,14R,17R)-17-[(1R)-1,5-dimethylhexyl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol(3S,5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol24,25-Dihydrolanosterol24-dihydrolanosterol3beta-Hydroxylanost-8-ene5alpha-Lanost-8-en-3beta-ol79-62-9C05109CHEBI:28113DihydrolanosterinDihydrolanosterolLMST01010087Lanost-8-en-3-ol, (3.beta.)-LanostenolLanosterol, dihydro-
Cross References
Trusted external identifiers retained for this final record.
Cas
79-62-9
Herb
HBIN032622
Npass
NPC189180
Tcmsp
MOL009677
Sym Map
SMIT10769
Pub Chem
440560
Tcmbank
TCMBANKIN006865
Etcm Ingredient
lanost-8-en-3beta-ol
Itcmdb Generated
ITX-INGREDIENT-CE02507C3CDD
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C30H52O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h20-22,25-26,31H,9-19H2,1-8H3/t21-,22-,25+,26+,28-,29-,30+/m1/s1
Mol Wt
428.7450000000002
Cas Id
79-62-9
Smiles
CC(C)CCCC(C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C
Mol Log P
8.559000000000006
Version
v1,v2
In Ch Ikey
MBZYKEVPFYHDOH-BQNIITSRSA-N
Ob Score
34.22634.2263037334.226304
Suppress
0
Num Hdonors
1
Drug Likeness
0.435
Num Hacceptors
1
Isomeric Smiles
C[C@H](CCCC(C)C)[C@H]1CC[C@@]2([C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C
Molecule Weight
428.82
Canonical Smiles
CC(C)CCCC(C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C
Herb Alias Names
Dihydrolanosterol24,25-Dihydrolanosterol79-62-9LanostenolDihydrolanosterin5alpha-Lanost-8-en-3beta-ol24-dihydrolanosterolLanosterol, dihydro-3beta-Hydroxylanost-8-eneLanost-8-en-3-ol, (3.beta.)-
Molecular Weight
428.400
Molecular Weight
428.73
Molecular Formula
C30H52O
Molecular Formula
C30H52O
Molecular Formula
C30H52O
Num Rotatable Bonds
5
Fda Maximum Daily Dose (Fdamdd)
0.676
Quantitative Estimate Of Drug Likeness（Qed）
0.435