7-[3-[(butanoylamino)methyl]-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-heptanoic acid

Systemtic Name: 7-[3-[(butanoylamino)methyl]-2-[(E)-oct-1-enyl]-5-oxidanylidene-cyclopentyl]-2-oxidanyl-heptanoic acid Openeye Name: 7-[3-[(butanoylamino)methyl]-2-[(E)-oct-1-enyl]-5-oxo-cyclopentyl]-2-hydroxy-heptanoic acid CAS Name: 2-hydroxy-7-[2-[(E)-oct-1-enyl]-5-oxo-3-[(1-oxobutylamino)methyl]cyclopentyl]heptanoic acid IUPAC Name: 7-[3-[(butanoylamino)methyl]-2-[(E)-oct-1-enyl]-5-oxocyclopentyl]-2-hydroxyheptanoic acid Traditional Name: 7-[3-(butyramidomethyl)-5-keto-2-[(E)-oct-1-enyl]cyclopentyl]-2-hydroxy-enanthic acid Formula: C25H43NO5 MolecularWeight: 437.61262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1C(CC(=O)C1CCCCCC(C(=O)O)O)CNC(=O)CCC

Isomeric SMILES

CCCCCC/C=C/C1C(CC(=O)C1CCCCCC(C(=O)O)O)CNC(=O)CCC

InChI

InChI=1S/C25H43NO5/c1-3-5-6-7-8-10-14-20-19(18-26-24(29)13-4-2)17-23(28)21(20)15-11-9-12-16-22(27)25(30)31/h10,14,19-22,27H,3-9,11-13,15-18H2,1-2H3,(H,26,29)(H,30,31)/b14-10+