(2R)-4-methyl-2-[[(12E,15E)-9-oxidanyl-10-oxidanylidene-octadeca-12,15-dienoyl]amino]pentanoic acid

Systemtic Name: (2R)-4-methyl-2-[[(12E,15E)-9-oxidanyl-10-oxidanylidene-octadeca-12,15-dienoyl]amino]pentanoic acid Openeye Name: (2R)-2-[[(12E,15E)-9-hydroxy-10-oxo-octadeca-12,15-dienoyl]amino]-4-methyl-pentanoic acid CAS Name: (2R)-2-[[(12E,15E)-9-hydroxy-1,10-dioxooctadeca-12,15-dienyl]amino]-4-methylpentanoic acid IUPAC Name: (2R)-2-[[(12E,15E)-9-hydroxy-10-oxooctadeca-12,15-dienoyl]amino]-4-methylpentanoic acid Traditional Name: (2R)-2-[[(12E,15E)-9-hydroxy-10-keto-octadeca-12,15-dienoyl]amino]-4-methyl-valeric acid Formula: C24H41NO5 MolecularWeight: 423.58604

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCC(=O)C(CCCCCCCC(=O)NC(CC(C)C)C(=O)O)O

Isomeric SMILES

CC/C=C/C/C=C/CC(=O)C(CCCCCCCC(=O)N[C@H](CC(C)C)C(=O)O)O

InChI

InChI=1S/C24H41NO5/c1-4-5-6-7-9-12-15-21(26)22(27)16-13-10-8-11-14-17-23(28)25-20(24(29)30)18-19(2)3/h5-6,9,12,19-20,22,27H,4,7-8,10-11,13-18H2,1-3H3,(H,25,28)(H,29,30)/b6-5+,12-9+/t20-,22?/m1/s1