IngredientID 1579
2alpha-hydroxy-7beta,9alpha,10beta,13alpha-tetraacetoxy-5alpha-(2'-hydroxy-3'-n,n-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene
C39H53NO12
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
- 1579
- Core Entity Id
- 4945
- Source Entity Count
- 1
- Preferred Name
- 2alpha-hydroxy-7beta,9alpha,10beta,13alpha-tetraacetoxy-5alpha-(2'-hydroxy-3'-n,n-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C39H53NO12
- Molecular Weight
- 727.3600
- 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-Hydroxy-7-beta,9-alpha,10-beta,13-alpha-tetraacetoxy-5-alpha-(2'-hydroxy-3'-N,N-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
2alpha-hydroxy-7beta,9alpha,10beta,13alpha-tetraacetoxy-5alpha-(2'-hydroxy-3'-n,n-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2alpha-hydroxy-7beta,9alpha,10beta,13alpha-tetraacetoxy-5alpha-(2'-hydroxy-3'-n,n-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene
Role
preferred
Source
itcmdb_public
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
2-alpha-Hydroxy-7-beta,9-alpha,10-beta,13-alpha-tetraacetoxy-5-alpha-(2'-hydroxy-3'-N,N-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN005285
Tcmid
10741
Etcm Ingredient
2-alpha-Hydroxy-7-beta,9-alpha,10-beta,13-alpha-tetraacetoxy-5-alpha-(2'-hydroxy-3'-N,N-dimethylamino-3'-phenyl)-propionyloxytaxa-4(20),11-diene
Itcmdb Generated
ITX-INGREDIENT-69152622E4DA
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
727.360
Molecular Formula
C39H53NO12
Molecular Formula
C39H53NO12
Fda Maximum Daily Dose (Fdamdd)
0.930
Quantitative Estimate Of Drug Likeness（Qed）
0.215