01
Ingredients
(3r,4ar,6as,6bs,8as,11r,12ar,14bs)-4,4,6a,6b,8a,11,14b-heptamethyl-11-methylol-1,2,3,4a,7,8,9,10,12,12a,13,14-dodecahydropicen-3-ol
C30H48O2
- Entity Type
- Ingredients
- Relation Groups
- 2
- Relation Preview
- 5
Basic Information
Grouped by core information, identifiers, and descriptions.
Core Information
- Name
- (3r,4ar,6as,6bs,8as,11r,12ar,14bs)-4,4,6a,6b,8a,11,14b-heptamethyl-11-methylol-1,2,3,4a,7,8,9,10,12,12a,13,14-dodecahydropicen-3-ol
- Molecular Formula
- C30H48O2
- Molecular Weight
- No data
- Canonical SMILES
- CC1(C(CCC2(C1C=CC3=C2CCC4(C3(CCC5(C4CC(CC5)(C)CO)C)C)C)C)O)C
- Isomeric SMILES
- C[C@]12CC[C@@](C[C@H]1[C@@]3(CCC4=C([C@]3(CC2)C)C=C[C@@H]5[C@@]4(CC[C@H](C5(C)C)O)C)C)(C)CO
- InChI
- InChI=1S/C30H48O2/c1-25(2)22-9-8-21-20(28(22,5)12-11-24(25)32)10-13-30(7)23-18-26(3,19-31)14-15-27(23,4)16-17-29(21,30)6/h8-9,22-24,31-32H,10-19H2,1-7H3/t22-,23+,24+,26+,27+,28+,29+,30-/m0/s1
- Oral Bioavailability
- No data
- Drug Likeness
- 0.458
- 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
