4-[[(2Z,4E,6E,8S)-6-methyl-8-oxidanyl-dodeca-2,4,6-trienoyl]amino]butanoate

Systemtic Name: 4-[[(2Z,4E,6E,8S)-6-methyl-8-oxidanyl-dodeca-2,4,6-trienoyl]amino]butanoate Openeye Name: 4-[[(2Z,4E,6E,8S)-8-hydroxy-6-methyl-dodeca-2,4,6-trienoyl]amino]butanoate CAS Name: 4-[[(2Z,4E,6E,8S)-8-hydroxy-6-methyl-1-oxododeca-2,4,6-trienyl]amino]butanoate IUPAC Name: 4-[[(2Z,4E,6E,8S)-8-hydroxy-6-methyldodeca-2,4,6-trienoyl]amino]butanoate Traditional Name: 4-[[(2Z,4E,6E,8S)-8-hydroxy-6-methyl-dodeca-2,4,6-trienoyl]amino]butyrate Formula: C17H26NO4- MolecularWeight: 308.39264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=C(C)C=CC=CC(=O)NCCCC(=O)[O-])O

Isomeric SMILES

CCCC[C@@H](/C=C(\C)/C=C/C=C\C(=O)NCCCC(=O)[O-])O

InChI

InChI=1S/C17H27NO4/c1-3-4-9-15(19)13-14(2)8-5-6-10-16(20)18-12-7-11-17(21)22/h5-6,8,10,13,15,19H,3-4,7,9,11-12H2,1-2H3,(H,18,20)(H,21,22)/p-1/b8-5+,10-6-,14-13+/t15-/m0/s1