IngredientID 68125

3-methoxy-3',4,9,9'-tetrahydroxy-4',7-epoxy-5',8-lignan-3'-O-β-D-glucopyranoside

C25H32O11

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Herb: 1Ingredient: 1Links: 1
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
68125
Core Entity Id
130774
Source Entity Count
1
Preferred Name
3-methoxy-3',4,9,9'-tetrahydroxy-4',7-epoxy-5',8-lignan-3'-O-β-D-glucopyranoside
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C25H32O11
Molecular Weight
508.1900
Inchikey
Inchi
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
Num H Donors
Num H Acceptors
Num Rotatable Bonds
Drug Likeness
Polar Surface Area
Molecular Volume
Alogp

Names

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

Name
3-methoxy-3',4,9,9'-tetrahydroxy-4',7-epoxy-5',8-lignan-3'-O-β-D-glucopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Etcm Ingredient
3-methoxy-3',4,9,9'-tetrahydroxy-4',7-epoxy-5',8-lignan-3'-O-β-D-glucopyranoside
Itcmdb Generated
ITX-INGREDIENT-E3C17FEA85A9

Attributes

Merged source attributes and domain-specific metadata.

Molecular Weight
508.190
Molecular Formula
C25H32O11
Fda Maximum Daily Dose (Fdamdd)
0.036
Quantitative Estimate Of Drug Likeness(Qed)
0.237