(2S,3R,6E,8E)-2-azanyl-3-oxidanyl-5-oxidanylidene-hexadeca-6,8-dienoic acid

Systemtic Name: (2S,3R,6E,8E)-2-azanyl-3-oxidanyl-5-oxidanylidene-hexadeca-6,8-dienoic acid Openeye Name: (2S,3R,6E,8E)-2-amino-3-hydroxy-5-oxo-hexadeca-6,8-dienoic acid CAS Name: (2S,3R,6E,8E)-2-amino-3-hydroxy-5-oxohexadeca-6,8-dienoic acid IUPAC Name: (2S,3R,6E,8E)-2-amino-3-hydroxy-5-oxohexadeca-6,8-dienoic acid Traditional Name: (2S,3R,6E,8E)-2-amino-3-hydroxy-5-keto-hexadeca-6,8-dienoic acid Formula: C16H27NO4 MolecularWeight: 297.38988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CC=CC(=O)CC(C(C(=O)O)N)O

Isomeric SMILES

CCCCCCC/C=C/C=C/C(=O)C[C@H]([C@@H](C(=O)O)N)O

InChI

InChI=1S/C16H27NO4/c1-2-3-4-5-6-7-8-9-10-11-13(18)12-14(19)15(17)16(20)21/h8-11,14-15,19H,2-7,12,17H2,1H3,(H,20,21)/b9-8+,11-10+/t14-,15+/m1/s1