IngredientID 46405
3,3',5,5'-Tetramethoxy-7,9'7',9-Diepoxy-Lignan-4,4'-Di-O-Β-D-Glucopyranoside
C34H46O18
Relationship Network
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Herb: 1Ingredient: 1Links: 1
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Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 46405
- Core Entity Id
- 89416
- Source Entity Count
- 1
- Preferred Name
- 3,3',5,5'-Tetramethoxy-7,9'7',9-Diepoxy-Lignan-4,4'-Di-O-Β-D-Glucopyranoside
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C34H46O18
- Molecular Weight
- 742.8000
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- 5.1858
- 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
3,3',5,5'-Tetramethoxy-7,9'7',9-Diepoxy-Lignan-4,4'-Di-O-Β-D-Glucopyranoside
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
3,3',5,5'-tetramethoxy-7,9'7',9-diepoxy-lignan-4,4'-di-O-β-D-glucopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
3,3',5,5'-tetramethoxy-7,9'7',9-diepoxy-lignan-4,4'-di-O-β-D-glucopyranoside
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN021660
Etcm Ingredient
3,3',5,5'-tetramethoxy-7,9'7',9-diepoxy-lignan-4,4'-di-O-β-D-glucopyranoside
Itcmdb Generated
ITX-INGREDIENT-ECEB9F5CE381
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v1,v2
Ob Score
5.1858147665.185815
Suppress
0
Molecule Weight
742.8
Molecular Weight
742.270
Molecular Weight
742.8
Molecular Formula
C34H46O18
Fda Maximum Daily Dose (Fdamdd)
0.045
Quantitative Estimate Of Drug Likeness（Qed）
0.119