Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 12Links: 13
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 68841
- Core Entity Id
- 131490
- Source Entity Count
- 1
- Preferred Name
- 5,7,4'-trihydroxyisoflavone
- Name En
- Pubchem Id
- 5280961
- Smiles Canonical
- C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O
- Molecular Formula
- C15H10O5
- Molecular Weight
- 270.0500
- Inchikey
- TZBJGXHYKVUXJN-UHFFFAOYSA-N
- Inchi
- InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.7000
- Num H Donors
- 3
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 87.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
5,7,4'-trihydroxyisoflavone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
5,7,4'-trihydroxyisoflavone
Itcmdb Generated
ITX-INGREDIENT-C195B75C5DE4
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
270.050
Molecular Formula
C15H10O5
Fda Maximum Daily Dose (Fdamdd)
0.201
Quantitative Estimate Of Drug Likeness（Qed）
0.632