(E)-2-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanylhexadec-3-enoic acid

Systemtic Name: (E)-2-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)sulfanylhexadec-3-enoic acid Openeye Name: (E)-2-(2-amino-3-hydroxy-3-oxo-propyl)sulfanylhexadec-3-enoic acid CAS Name: (E)-2-[(2-amino-3-hydroxy-3-oxopropyl)thio]-3-hexadecenoic acid IUPAC Name: (E)-2-(2-amino-3-hydroxy-3-oxopropyl)sulfanylhexadec-3-enoic acid Traditional Name: (E)-2-[(2-amino-3-hydroxy-3-keto-propyl)thio]hexadec-3-enoic acid Formula: C19H35NO4S MolecularWeight: 373.5505

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=CC(C(=O)O)SCC(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCC/C=C/C(C(=O)O)SCC(C(=O)O)N

InChI

InChI=1S/C19H35NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19(23)24)25-15-16(20)18(21)22/h13-14,16-17H,2-12,15,20H2,1H3,(H,21,22)(H,23,24)/b14-13+