L-Proline, 5-oxo-, ester with retinol
Basic information
- CAS
85026-82-0- Standard SMILES
CC1=C(/C=C/C(C)=C/C=C/C(C)=C/COC(=O)[C@@H]2CCC(=O)N2)C(C)(C)CCC1- InChIKey
XJHHKIWNZGGGJL-ZNQJJDDXSA-N- Molecular formula
- C25H35NO3
- Average molar mass
- 397.5 g/mol
- Monoisotopic mass
- 397.26169398
Names & identifiers
- Preferred name
- L-Proline, 5-oxo-, ester with retinol
- IUPAC
- [(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] (2S)-5-oxopyrrolidine-2-carboxylate
Names & synonyms
DTXSID901288759L-Proline, 5-oxo-, ester with retinol
Database identifiers
- CAS
85026-82-0- PubChem CID
- 102438355
- DTXSID
DTXSID901288759- Nikkaji
- J309.592D
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 778
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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