01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 5
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- 14alpha-methyl-5alpha-ergosta-9(11)-en-3beta-ol
- Molecular Formula
- C29H50O
- Molecular Weight
- No data
- Canonical SMILES
- CC(C)C(C)CCC(C)C1CCC2(C1(CC=C3C2CCC4C3(CCC(C4)O)C)C)C
- Isomeric SMILES
- C[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@]2([C@@]1(CC=C3[C@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C)C
- InChI
- InChI=1S/C29H50O/c1-19(2)20(3)8-9-21(4)24-13-16-29(7)26-11-10-22-18-23(30)12-15-27(22,5)25(26)14-17-28(24,29)6/h14,19-24,26,30H,8-13,15-18H2,1-7H3/t20-,21+,22-,23-,24+,26+,27-,28+,29-/m0/s1
- Oral Bioavailability
- 8.852
- Drug Likeness
- 0.451
- 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.