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: 5Links: 6
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 44988
- Core Entity Id
- 87999
- Source Entity Count
- 1
- Preferred Name
- Ergosta-7,22-Dien-3Β-Ol
- Name En
- Pubchem Id
- 3375145
- Smiles Canonical
- C=C(CCC(C)C1CCC2C3=C(CCC21C)C1(C)CCC(O)CC1CC3)C(C)C
- Molecular Formula
- C28H46O
- Molecular Weight
- 398.7400
- Inchikey
- SLQKYSPHBZMASJ-UHFFFAOYSA-N
- Inchi
- InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h18,20-22,24-25,29H,3,7-17H2,1-2,4-6H3
- Isomeric Smiles
- Cas Id
- Ob Score
- 43.5071
- Mol Logp
- 8.1000
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 5
- Drug Likeness
- Polar Surface Area
- 20.2000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Ergosta-7,22-Dien-3Β-Ol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
ergosta-7,22-dien-3β-ol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
ergosta-7,22-dien-3β-ol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
24-methylcholesta-7,22-dien-3β-ol
Role
alias
Source
TCMBank
Preferred
No
Name
Ergosta-7,22-dien-3β-ol
Role
alias
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
24-methylcholesta-7,22-dien-3β-ol
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN016937
Etcm Ingredient
ergosta-7,22-dien-3β-ol
Itcmdb Generated
ITX-INGREDIENT-DE670D3CB828
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Smiles
CC(C)C(=C)CCC(C)C1CCC2C1(CCC3=C2CCC4C3(CCC(C4)O)C)C
Version
v1,v2
Ob Score
43.50708643.50708637
Suppress
0
Molecule Weight
398.74
Molecular Weight
398.350
Molecular Weight
398.74
Molecular Formula
C28H46O
Fda Maximum Daily Dose (Fdamdd)
0.966
Quantitative Estimate Of Drug Likeness（Qed）
0.489