Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 5Links: 5
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 72146
- Core Entity Id
- 134795
- Source Entity Count
- 1
- Preferred Name
- ganoderic acid A
- Name En
- Pubchem Id
- 471002
- Smiles Canonical
- CC(CC(=O)CC(C)C(=O)O)C1CC(C2(C1(CC(=O)C3=C2C(CC4C3(CCC(=O)C4(C)C)C)O)C)C)O
- Molecular Formula
- C30H44O7
- Molecular Weight
- 516.3100
- Inchikey
- DYOKDAQBNHPJFD-JNTBEZBXSA-N
- Inchi
- InChI=1S/C30H44O7/c1-15(10-17(31)11-16(2)26(36)37)18-12-23(35)30(7)25-19(32)13-21-27(3,4)22(34)8-9-28(21,5)24(25)20(33)14-29(18,30)6/h15-16,18-19,21,23,32,35H,8-14H2,1-7H3,(H,36,37)/t15-,16-,18-,19+,21+,23+,28+,29-,30+/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.2000
- Num H Donors
- 3
- Num H Acceptors
- 7
- Num Rotatable Bonds
- 6
- Drug Likeness
- Polar Surface Area
- 129.0000
- Molecular Volume
- Alogp
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
516.310
Molecular Formula
C30H44O7
Fda Maximum Daily Dose (Fdamdd)
0.596
Quantitative Estimate Of Drug Likeness（Qed）
0.540