Basic information
- Standard SMILES
CCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCC[C@H](O)CCCCC- InChIKey
VDFZFEALQJFOTL-GDLZYMKVSA-N- Molecular formula
- C31H60O3
- Average molar mass
- 480.8 g/mol
- Monoisotopic mass
- 480.45424578
Overview
(26R)-26-hydroxyhentriacontane-14,16-dione has been reported in Hordeum vulgare and Elymus lanceolatus with data available.
Names & identifiers
- Preferred name
- (26R)-26-hydroxyhentriacontane-14,16-dione
- IUPAC
- (26R)-26-hydroxyhentriacontane-14,16-dione
Names & synonyms
89357-00-6
Properties
Computed structural properties
- XLogP
- 11.5
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 28
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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