IngredientID 67825

3,4'-dihydroxyflavone

C15H10O4

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Relationship Network

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Ingredient: 1Target: 16Links: 24
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
67825
Core Entity Id
130474
Source Entity Count
1
Preferred Name
3,4'-dihydroxyflavone
Name En
Pubchem Id
688715
Smiles Canonical
C1=CC=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)O)O
Molecular Formula
C15H10O4
Molecular Weight
254.0600
Inchikey
GPGOCTLAUAHUQO-UHFFFAOYSA-N
Inchi
InChI=1S/C15H10O4/c16-10-7-5-9(6-8-10)15-14(18)13(17)11-3-1-2-4-12(11)19-15/h1-8,16,18H
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
3.0000
Num H Donors
2
Num H Acceptors
4
Num Rotatable Bonds
1
Drug Likeness
Polar Surface Area
66.8000
Molecular Volume
Alogp

Names

Preferred names, aliases, and source labels retained in the final schema.

Name
3,4'-dihydroxyflavone
Role
preferred
Source
ETCM_v2
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Etcm Ingredient
3,4'-dihydroxyflavone
Itcmdb Generated
ITX-INGREDIENT-186DAE289985

Attributes

Merged source attributes and domain-specific metadata.

Molecular Weight
254.060
Molecular Formula
C15H10O4
Fda Maximum Daily Dose (Fdamdd)
0.024
Quantitative Estimate Of Drug Likeness(Qed)
0.700