Basic information
- Standard SMILES
CCCCCCCCCCC[C@H](CC(=O)N[C@@H](CO)C(=O)OCc1ccccc1)OC(=O)CCCCCC- InChIKey
HCXPOHVUPDVFEH-IZLXSDGUSA-N- Molecular formula
- C31H51NO6
- Average molar mass
- 533.7 g/mol
- Monoisotopic mass
- 533.37163835
Names & identifiers
- Preferred name
- N-[(R)-3-heptanoyloxytetradecanoyl]-L-serine benzyl ester
- IUPAC
- [(3R)-1-[[(2S)-3-hydroxy-1-oxo-1-phenylmethoxypropan-2-yl]amino]-1-oxotetradecan-3-yl] heptanoate
Names & synonyms
SCHEMBL3939841HCXPOHVUPDVFEH-IZLXSDGUSA-NN-[(R)-3-heptanoyloxytetradecanoyl]-L-serine benzyl ester
Database identifiers
- PubChem CID
- 53870673
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 25
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 619
Related reactions
6 records
Compound notes
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