Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 6Links: 7
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 68625
- Core Entity Id
- 131274
- Source Entity Count
- 1
- Preferred Name
- 4'-methoxyflavonol
- Name En
- Pubchem Id
- 97141
- Smiles Canonical
- COC1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)O
- Molecular Formula
- C16H12O4
- Molecular Weight
- 268.0700
- Inchikey
- IIBBFGMVMNZMGA-UHFFFAOYSA-N
- Inchi
- InChI=1S/C16H12O4/c1-19-11-8-6-10(7-9-11)16-15(18)14(17)12-4-2-3-5-13(12)20-16/h2-9,18H,1H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 3.4000
- Num H Donors
- 1
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 55.8000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
4'-methoxyflavonol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
4'-methoxyflavonol
Itcmdb Generated
ITX-INGREDIENT-8D46890D6F39
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
268.070
Molecular Formula
C16H12O4
Fda Maximum Daily Dose (Fdamdd)
0.023
Quantitative Estimate Of Drug Likeness（Qed）
0.775