IngredientID 4971
3-o-beta-d-glucuronopyranosyl-2beta,3beta,16beta-trihy-droxy-28-norolean-12-en-15-on-23-oicacid
C35H52O12
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
- 4971
- Core Entity Id
- 8717
- Source Entity Count
- 1
- Preferred Name
- 3-o-beta-d-glucuronopyranosyl-2beta,3beta,16beta-trihy-droxy-28-norolean-12-en-15-on-23-oicacid
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C35H52O12
- Molecular Weight
- 664.3500
- 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--beta-D-Glucuronopyranosyl-2-beta,3-beta,16-beta-trihydroxy-28-norolean-12-en-15-on-23-oic acid
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
3-o-beta-d-glucuronopyranosyl-2beta,3beta,16beta-trihy-droxy-28-norolean-12-en-15-on-23-oicacid
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
3-o-beta-d-glucuronopyranosyl-2beta,3beta,16beta-trihy-droxy-28-norolean-12-en-15-on-23-oicacid
Role
preferred
Source
HERB_v2
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
3-O--beta-D-Glucuronopyranosyl-2-beta,3-beta,16-beta-trihydroxy-28-norolean-12-en-15-on-23-oic acid
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN009236
Tcmid
8766
Etcm Ingredient
3-O--beta-D-Glucuronopyranosyl-2-beta,3-beta,16-beta-trihydroxy-28-norolean-12-en-15-on-23-oic acid
Itcmdb Generated
ITX-INGREDIENT-33743070AC40
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
664.350
Molecular Formula
C35H52O12
Molecular Formula
C35H52O12
Fda Maximum Daily Dose (Fdamdd)
0.039
Quantitative Estimate Of Drug Likeness（Qed）
0.170