[(2S)-2-[(2S)-2-azanyl-3-methoxy-propanoyl]oxy-3-oxidanyl-propyl] (9Z,12Z)-octadeca-9,12-dienoate

Systemtic Name: [(2S)-2-[(2S)-2-azanyl-3-methoxy-propanoyl]oxy-3-oxidanyl-propyl] (9Z,12Z)-octadeca-9,12-dienoate Openeye Name: [(2S)-2-[(2S)-2-amino-3-methoxy-propanoyl]oxy-3-hydroxy-propyl] (9Z,12Z)-octadeca-9,12-dienoate CAS Name: (9Z,12Z)-octadeca-9,12-dienoic acid [(2S)-2-[(2S)-2-amino-3-methoxy-1-oxopropoxy]-3-hydroxypropyl] ester IUPAC Name: [(2S)-2-[(2S)-2-amino-3-methoxypropanoyl]oxy-3-hydroxypropyl] (9Z,12Z)-octadeca-9,12-dienoate Traditional Name: (9Z,12Z)-octadeca-9,12-dienoic acid [(2S)-2-[(2S)-2-amino-3-methoxy-propanoyl]oxy-3-hydroxy-propyl] ester Formula: C25H45NO6 MolecularWeight: 455.6279

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)OCC(CO)OC(=O)C(COC)N

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)[C@H](COC)N

InChI

InChI=1S/C25H45NO6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(28)31-20-22(19-27)32-25(29)23(26)21-30-2/h7-8,10-11,22-23,27H,3-6,9,12-21,26H2,1-2H3/b8-7-,11-10-/t22-,23-/m0/s1