Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 8Ingredient: 1Links: 8
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 70090
- Core Entity Id
- 132739
- Source Entity Count
- 1
- Preferred Name
- Apigenin-7-O-glucoside
- Name En
- Pubchem Id
- 12304093
- Smiles Canonical
- C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O
- Molecular Formula
- C21H20O10
- Molecular Weight
- 432.1100
- Inchikey
- KMOUJOKENFFTPU-MKJMBMEGSA-N
- Inchi
- InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21?/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -0.1000
- Num H Donors
- 6
- Num H Acceptors
- 10
- Num Rotatable Bonds
- 4
- Drug Likeness
- Polar Surface Area
- 166.0000
- Molecular Volume
- Alogp
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
Apigenin-7-O-glucoside
Itcmdb Generated
ITX-INGREDIENT-37776F8560AB
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
432.110
Molecular Formula
C21H20O10
Fda Maximum Daily Dose (Fdamdd)
0.014
Quantitative Estimate Of Drug Likeness（Qed）
0.331