IngredientID 67
21beta-o-benzoylsitakisogenin 3-o-beta-d-glucopyra-nosyl(1→3)-beta-d-glucuronopyranoside
C49H72O16
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
- 67
- Core Entity Id
- 704
- Source Entity Count
- 1
- Preferred Name
- 21beta-o-benzoylsitakisogenin 3-o-beta-d-glucopyra-nosyl(1→3)-beta-d-glucuronopyranoside
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C49H72O16
- Molecular Weight
- 916.4800
- 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
21-beta-O-Benzoylsitakisogenin 3-O--beta-D-glucopyranosyl(1->3)--beta-D-glucuronopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
21beta-o-benzoylsitakisogenin 3-o-beta-d-glucopyra-nosyl(1→3)-beta-d-glucuronopyranoside
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
21beta-o-benzoylsitakisogenin 3-o-beta-d-glucopyra-nosyl(1→3)-beta-d-glucuronopyranoside
Role
preferred
Source
itcmdb_public
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
21-beta-O-Benzoylsitakisogenin 3-O--beta-D-glucopyranosyl(1->3)--beta-D-glucuronopyranoside
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN003564
Tcmid
2271
Etcm Ingredient
21-beta-O-Benzoylsitakisogenin 3-O--beta-D-glucopyranosyl(1->3)--beta-D-glucuronopyranoside
Itcmdb Generated
ITX-INGREDIENT-EA8479C1F9B4
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
916.480
Molecular Formula
C49H72O16
Molecular Formula
C49H72O16
Fda Maximum Daily Dose (Fdamdd)
0.961
Quantitative Estimate Of Drug Likeness（Qed）
0.098