01
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 3
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- Sarmentolin
- Molecular Formula
- C30H48O3
- Molecular Weight
- No data
- Canonical SMILES
- CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2(C1)OO)C)C)C
- Isomeric SMILES
- C[C@@]12CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC(=O)C5(C)C)C)C)[C@@]1(CC(CC2)(C)C)OO)C
- InChI
- InChI=1S/C30H48O3/c1-24(2)15-16-26(5)17-18-29(8)22(30(26,19-24)33-32)10-9-21-27(6)13-12-23(31)25(3,4)20(27)11-14-28(21,29)7/h10,20-21,32H,9,11-19H2,1-8H3/t20-,21+,26+,27-,28+,29+,30+/m0/s1
- Oral Bioavailability
- 11.899
- Drug Likeness
- 0.247
- 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.
Active Targets
ingredient target2 Targets