IngredientID 68593

4'-hydroxyl-3,3',4,5,5'-pen-tamethoxy-7,7'-epoxylignan

C23H30O7

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Relationship Network

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

Scalar fields from the final ingredient record.

Ingredient Id
68593
Core Entity Id
131242
Source Entity Count
1
Preferred Name
4'-hydroxyl-3,3',4,5,5'-pen-tamethoxy-7,7'-epoxylignan
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C23H30O7
Molecular Weight
418.2000
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
4'-hydroxyl-3,3',4,5,5'-pen-tamethoxy-7,7'-epoxylignan
Role
preferred
Source
ETCM_v2
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Etcm Ingredient
4'-hydroxyl-3,3',4,5,5'-pen-tamethoxy-7,7'-epoxylignan
Itcmdb Generated
ITX-INGREDIENT-138B5B7EC81C

Attributes

Merged source attributes and domain-specific metadata.

Molecular Weight
418.200
Molecular Formula
C23H30O7
Fda Maximum Daily Dose (Fdamdd)
0.022
Quantitative Estimate Of Drug Likeness(Qed)
0.708