01
Ingredients
2alpha-hydroxy-5alpha,10beta,14beta-triacetoxytaxa-4(20),11-diene
C26H38O7
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 3
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 2alpha-hydroxy-5alpha,10beta,14beta-triacetoxytaxa-4(20),11-diene
- Molecular Formula
- C26H38O7
- Molecular Weight
- No data
- Canonical SMILES
- CC1=C2C(CC3(CCC(C(=C)C3C(C(C2(C)C)C(C1)OC(=O)C)O)OC(=O)C)C)OC(=O)C
- Isomeric SMILES
- CC1=C2[C@H](C[C@@]3(CC[C@@H](C(=C)[C@H]3[C@@H]([C@@H](C2(C)C)[C@H](C1)OC(=O)C)O)OC(=O)C)C)OC(=O)C
- InChI
- InChI=1S/C26H38O7/c1-13-11-19(32-16(4)28)23-24(30)22-14(2)18(31-15(3)27)9-10-26(22,8)12-20(33-17(5)29)21(13)25(23,6)7/h18-20,22-24,30H,2,9-12H2,1,3-8H3/t18-,19-,20-,22-,23-,24-,26-/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.386
- DL Score
- No data
- Caco-2 Permeability
- No data
- ALogP
- No data
- Bioavailability Score
- No data
Identifiers
- InChI Key
- No data
- PubChem CID
- No data
Description and Extensions
- Toxicity Information
- No data
Related
Related Entities
Direct relations and traceable candidates grouped by relation type.
Source Herbs
herb ingredient2 Herbs