IngredientID 42723
3-o-[α-l-rhamnopyranosyl-(1→3)-β-d-glucu-ronopyranosyl]-28-o-[β-d-xylopyranosyl(1→2)-β-d-glucopyranosyl]-3β-hydroxyolean-12-en-28-oate
C53H84O21
Relationship Network
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Herb: 1Ingredient: 1Target: 2Links: 5
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Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 42723
- Core Entity Id
- 85734
- Source Entity Count
- 1
- Preferred Name
- 3-o-[α-l-rhamnopyranosyl-(1→3)-β-d-glucu-ronopyranosyl]-28-o-[β-d-xylopyranosyl(1→2)-β-d-glucopyranosyl]-3β-hydroxyolean-12-en-28-oate
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C53H84O21
- Molecular Weight
- 1056.5500
- 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-O-[α-L-Rhamnopyranosyl- (1→3)-β-D-glucuronopyranosyl]-28-O-[β-D- xylopyranosyl (1→2)-β-D-glucopyranosyl]-3β-hydroxyolean-12-en-28-oate
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
3-o-[α-l-rhamnopyranosyl-(1→3)-β-d-glucu-ronopyranosyl]-28-o-[β-d-xylopyranosyl(1→2)-β-d-glucopyranosyl]-3β-hydroxyolean-12-en-28-oate
Role
preferred
Source
TCMBank
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
3-O-[α-L-Rhamnopyranosyl- (1→3)-β-D-glucuronopyranosyl]-28-O-[β-D- xylopyranosyl (1→2)-β-D-glucopyranosyl]-3β-hydroxyolean-12-en-28-oate
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN008973TCMBANKIN020822
Etcm Ingredient
3-O-[α-L-Rhamnopyranosyl- (1→3)-β-D-glucuronopyranosyl]-28-O-[β-D- xylopyranosyl (1→2)-β-D-glucopyranosyl]-3β-hydroxyolean-12-en-28-oate
Itcmdb Generated
ITX-INGREDIENT-366A463A9247ITX-INGREDIENT-7FE1CFA1AF5E
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
九层风
Tcm Name2
JIU CENG FENG
Mol2 Path
/TCM_database/2007_3d_all/18727.mol2
Reference
660
Molecular Weight
1056.550
Molecular Formula
C53H84O21
Molecular Formula
C53H84O22
Fda Maximum Daily Dose (Fdamdd)
0.938
Quantitative Estimate Of Drug Likeness（Qed）
0.078