Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 10Links: 20
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 67853
- Core Entity Id
- 130502
- Source Entity Count
- 1
- Preferred Name
- 3,5,6,4'-tetrahydroxy-7-methoxyflavone
- Name En
- Pubchem Id
- 14258996
- Smiles Canonical
- COC1=C(C(=C2C(=C1)OC(=C(C2=O)O)C3=CC=C(C=C3)O)O)O
- Molecular Formula
- C16H12O7
- Molecular Weight
- 316.0600
- Inchikey
- YLRSIAJFRWNBHO-UHFFFAOYSA-N
- Inchi
- InChI=1S/C16H12O7/c1-22-10-6-9-11(13(19)12(10)18)14(20)15(21)16(23-9)7-2-4-8(17)5-3-7/h2-6,17-19,21H,1H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.5000
- Num H Donors
- 4
- Num H Acceptors
- 7
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 116.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
3,5,6,4'-tetrahydroxy-7-methoxyflavone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
3,5,6,4'-tetrahydroxy-7-methoxyflavone
Itcmdb Generated
ITX-INGREDIENT-17BCC5F1897A
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
316.060
Molecular Formula
C16H12O7
Fda Maximum Daily Dose (Fdamdd)
0.059
Quantitative Estimate Of Drug Likeness（Qed）
0.535