IngredientID 43558
3-O-{[α-L-Rhamnopyranosyl-(1→2)-β-D-galactopyranosyl-(1→2)]-β-D-glucuronopyranosyl}-22-O-[α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl]-3β,22β,24-trihydroxyolean-12-ene
C58H94O27
Relationship Network
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Ingredient: 1Target: 1Links: 2
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Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 43558
- Core Entity Id
- 86569
- Source Entity Count
- 1
- Preferred Name
- 3-O-{[α-L-Rhamnopyranosyl-(1→2)-β-D-galactopyranosyl-(1→2)]-β-D-glucuronopyranosyl}-22-O-[α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl]-3β,22β,24-trihydroxyolean-12-ene
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C58H94O27
- Molecular Weight
- 1222.6000
- 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→2)-β-D-galactopyranosyl-(1→2)]-β-D-glucuronopyranosyl}-22-O-[α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl]-3β,22β,24-trihydroxyolean-12-ene
Role
preferred
Source
TCMBank
Preferred
Yes
Name
3-O-{[α-L-Rhamnopyranosyl-(1→2)-β-D-galactopyranosyl-(1→2)]-β-D-glucuronopyranosyl}-22-O-[α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl]-3β,22β,24-trihydroxyolean-12-ene
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN012017TCMBANKIN023492
Etcm Ingredient
3-O-{[α-L-Rhamnopyranosyl-(1→2)-β-D-galactopyranosyl-(1→2)]-β-D-glucuronopyranosyl}-22-O-[α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl]-3β,22β,24-trihydroxyolean-12-ene
Itcmdb Generated
ITX-INGREDIENT-3F2C79627A68ITX-INGREDIENT-667F589E00A1
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
大豆
Tcm Name2
DA DOU
Mol2 Path
/TCM_database/2007_3d_all/18700.mol2
Reference
4630
Molecular Weight
1222.600
Molecular Formula
C58H94O27
Molecular Formula
C59H96O26
Fda Maximum Daily Dose (Fdamdd)
0.013
Quantitative Estimate Of Drug Likeness（Qed）
0.064