IngredientID 41443
7,9,9'-Trihydroxy-3,3'-dimethoxy-8-O-4'-neolignan-4-O-β-Dglucopyranoside
C26H36O12
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
- 41443
- Core Entity Id
- 84454
- Source Entity Count
- 1
- Preferred Name
- 7,9,9'-Trihydroxy-3,3'-dimethoxy-8-O-4'-neolignan-4-O-β-Dglucopyranoside
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C26H36O12
- Molecular Weight
- 540.2200
- 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
7,9,9'-Trihydroxy-3,3'-dimethoxy-8-O-4'-neolignan-4-O-β-Dglucopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
7,9,9'-Trihydroxy-3,3'-dimethoxy-8-O-4'-neolignan-4-O-β-Dglucopyranoside
Role
preferred
Source
TCMBank
Preferred
Yes
Name
山矾根
Role
TCM_name
Source
TCMBank
Preferred
No
Name
SHAN FAN GEN
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Caudate Sweetleaf Root
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
山矾根SHAN FAN GENCaudate Sweetleaf Root
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN004555TCMBANKIN010968
Etcm Ingredient
7,9,9'-Trihydroxy-3,3'-dimethoxy-8-O-4'-neolignan-4-O-β-Dglucopyranoside
Itcmdb Generated
ITX-INGREDIENT-9991B48F05B6ITX-INGREDIENT-DBAD687641ED
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
山矾根
Tcm Name2
SHAN FAN GEN
Mol2 Path
/TCM_database/2007_3d_all/21714.mol2
Reference
2355
Tcm Name En
Caudate Sweetleaf Root
Molecular Weight
540.220
Molecular Formula
C26H36O12
Molecular Formula
C26H36O12
Fda Maximum Daily Dose (Fdamdd)
0.004
Quantitative Estimate Of Drug Likeness（Qed）
0.169