Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 14Links: 15
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 68849
- Core Entity Id
- 131498
- Source Entity Count
- 1
- Preferred Name
- 5,7-dihydrox-4'-methoxyisoflavone
- Name En
- Pubchem Id
- 5280373
- Smiles Canonical
- COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O
- Molecular Formula
- C16H12O5
- Molecular Weight
- 284.0700
- Inchikey
- WUADCCWRTIWANL-UHFFFAOYSA-N
- Inchi
- InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 3.0000
- Num H Donors
- 2
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 76.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
5,7-dihydrox-4'-methoxyisoflavone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
5,7-dihydrox-4'-methoxyisoflavone
Itcmdb Generated
ITX-INGREDIENT-79C411AF5487
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
284.070
Molecular Formula
C16H12O5
Fda Maximum Daily Dose (Fdamdd)
0.482
Quantitative Estimate Of Drug Likeness(Qed)
0.756