Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 68583
- Core Entity Id
- 131232
- Source Entity Count
- 1
- Preferred Name
- 4'-Hydroxy-5,6,7-trimethoxyflavone
- Name En
- Pubchem Id
- 243759
- Smiles Canonical
- COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)OC)OC
- Molecular Formula
- C18H16O6
- Molecular Weight
- 328.0900
- Inchikey
- PJRWXHDCKWSIRU-UHFFFAOYSA-N
- Inchi
- InChI=1S/C18H16O6/c1-21-15-9-14-16(18(23-3)17(15)22-2)12(20)8-13(24-14)10-4-6-11(19)7-5-10/h4-9,19H,1-3H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 1.8000
- Num H Donors
- 1
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 4
- Drug Likeness
- Polar Surface Area
- 74.2000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
4'-Hydroxy-5,6,7-trimethoxyflavone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
4'-Hydroxy-5,6,7-trimethoxyflavone
Itcmdb Generated
ITX-INGREDIENT-229699229C9D
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
328.090
Molecular Formula
C18H16O6
Fda Maximum Daily Dose (Fdamdd)
0.136
Quantitative Estimate Of Drug Likeness（Qed）
0.792