01
Ingredients
(2s,4as,8ar)-2,5,5,8a-tetramethyl-3,4,4a,6-tetrahydro-2h-chromene
C13H22O
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 9
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (2s,4as,8ar)-2,5,5,8a-tetramethyl-3,4,4a,6-tetrahydro-2h-chromene
- Molecular Formula
- C13H22O
- Molecular Weight
- No data
- Canonical SMILES
- CC1CCC2C(CC=CC2(O1)C)(C)C
- Isomeric SMILES
- C[C@H]1CC[C@@H]2[C@](O1)(C=CCC2(C)C)C
- InChI
- InChI=1S/C13H22O/c1-10-6-7-11-12(2,3)8-5-9-13(11,4)14-10/h5,9-11H,6-8H2,1-4H3/t10-,11-,13+/m0/s1
- Oral Bioavailability
- 47.603
- Drug Likeness
- 0.536
- 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 ingredient1 Herbs