01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 7
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 21-hydroxy-30-norhopan-22-one
- Molecular Formula
- C29H48O2
- Molecular Weight
- No data
- Canonical SMILES
- CC(=O)C1(CCC2(C1CCC3(C2CCC4C3(CCC5C4(CCCC5(C)C)C)C)C)C)O
- Isomeric SMILES
- CC(=O)[C@]1(CCC2([C@H]1CCC3([C@@H]2CCC4[C@]3(CCC5[C@@]4(CCCC5(C)C)C)C)C)C)O
- InChI
- InChI=1S/C29H48O2/c1-19(30)29(31)18-17-26(5)22-10-9-21-25(4)14-8-13-24(2,3)20(25)11-15-27(21,6)28(22,7)16-12-23(26)29/h20-23,31H,8-18H2,1-7H3/t20?,21?,22-,23-,25+,26?,27-,28?,29+/m1/s1
- Oral Bioavailability
- 34.108
- Drug Likeness
- 0.480
- 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.