IngredientID 1550
2alpha,5alpha-diacetoxy-14beta-(2's,3'r)-3'-hydroxy-2'alpha-methylbutanoate-10beta-o-(beta-d-glucopyranosyl)taxa-4(20),11-diene
C35H54O13
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
- 1550
- Core Entity Id
- 4913
- Source Entity Count
- 1
- Preferred Name
- 2alpha,5alpha-diacetoxy-14beta-(2's,3'r)-3'-hydroxy-2'alpha-methylbutanoate-10beta-o-(beta-d-glucopyranosyl)taxa-4(20),11-diene
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C35H54O13
- Molecular Weight
- 682.3600
- 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
2-alpha,5-alpha-Diacetoxy-14-beta-(2'S,3'R)-3'-hydroxy-2'-alpha-methylbutanoate-10-beta-O-(-beta-D-glucopyranosyl)taxa-4(20),11-diene
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
2alpha,5alpha-diacetoxy-14beta-(2's,3'r)-3'-hydroxy-2'alpha-methylbutanoate-10beta-o-(beta-d-glucopyranosyl)taxa-4(20),11-diene
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2alpha,5alpha-diacetoxy-14beta-(2's,3'r)-3'-hydroxy-2'alpha-methylbutanoate-10beta-o-(beta-d-glucopyranosyl)taxa-4(20),11-diene
Role
preferred
Source
itcmdb_public
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
2-alpha,5-alpha-Diacetoxy-14-beta-(2'S,3'R)-3'-hydroxy-2'-alpha-methylbutanoate-10-beta-O-(-beta-D-glucopyranosyl)taxa-4(20),11-diene
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN005250
Tcmid
5309
Etcm Ingredient
2-alpha,5-alpha-Diacetoxy-14-beta-(2'S,3'R)-3'-hydroxy-2'-alpha-methylbutanoate-10-beta-O-(-beta-D-glucopyranosyl)taxa-4(20),11-diene
Itcmdb Generated
ITX-INGREDIENT-8C3328F59621
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
682.360
Molecular Formula
C35H54O13
Molecular Formula
C35H54O13
Fda Maximum Daily Dose (Fdamdd)
0.777
Quantitative Estimate Of Drug Likeness（Qed）
0.141