Einecs 255-399-6
Basic information
- CAS
41489-07-0- Standard SMILES
CCCCCCCCCCCCCCCCOC(=O)[C@@H](N)CCCCN.O=C1CCC(C(=O)O)N1- InChIKey
VGNNYNWSNNGUJC-BOXHHOBZSA-N- Molecular formula
- C27H53N3O5
- Average molar mass
- 499.7 g/mol
- Monoisotopic mass
- 499.3985218
Names & identifiers
- Preferred name
- Einecs 255-399-6
- IUPAC
- hexadecyl (2S)-2,6-diaminohexanoate;5-oxopyrrolidine-2-carboxylic acid
Names & synonyms
EINECS 255-399-641489-07-05-Oxo-DL-proline, compound with hexadecyl L-lysinate (1:1)DTXSID909617575-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid--hexadecyl L-lysinate (1/1)5-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid--hexadecyl lysinate (1/1)
Database identifiers
- CAS
41489-07-0- PubChem CID
- 6451748
- DTXSID
DTXSID90961757- EC Number
- 255-399-6
Properties
Computed structural properties
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 22
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 452
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Related reactions
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Compound notes
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