IngredientID 68958

5-hydroxy-3,3',4',7-tetramethoxyflavone

C19H18O7

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Relationship Network

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Herb: 1Ingredient: 1Target: 3Links: 4
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
68958
Core Entity Id
131607
Source Entity Count
1
Preferred Name
5-hydroxy-3,3',4',7-tetramethoxyflavone
Name En
Pubchem Id
5352005
Smiles Canonical
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)OC)OC
Molecular Formula
C19H18O7
Molecular Weight
358.1100
Inchikey
HHGPYJLEJGNWJA-UHFFFAOYSA-N
Inchi
InChI=1S/C19H18O7/c1-22-11-8-12(20)16-15(9-11)26-18(19(25-4)17(16)21)10-5-6-13(23-2)14(7-10)24-3/h5-9,20H,1-4H3
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
3.5000
Num H Donors
1
Num H Acceptors
7
Num Rotatable Bonds
5
Drug Likeness
Polar Surface Area
83.5000
Molecular Volume
Alogp

Names

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

Name
5-hydroxy-3,3',4',7-tetramethoxyflavone
Role
preferred
Source
ETCM_v2
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Etcm Ingredient
5-hydroxy-3,3',4',7-tetramethoxyflavone
Itcmdb Generated
ITX-INGREDIENT-BE99A139F146

Attributes

Merged source attributes and domain-specific metadata.

Molecular Weight
358.110
Molecular Formula
C19H18O7
Fda Maximum Daily Dose (Fdamdd)
0.132
Quantitative Estimate Of Drug Likeness(Qed)
0.749