2-[[(E)-15-oxidanylpentadec-7-en-6-yl]amino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[[(E)-15-oxidanylpentadec-7-en-6-yl]amino]-3-sulfanyl-propanoic acid Openeye Name: 2-[[(E)-10-hydroxy-1-pentyl-dec-2-enyl]amino]-3-sulfanyl-propanoic acid CAS Name: 2-[[(E)-15-hydroxypentadec-7-en-6-yl]amino]-3-mercaptopropanoic acid IUPAC Name: 2-[[(E)-15-hydroxypentadec-7-en-6-yl]amino]-3-sulfanylpropanoic acid Traditional Name: 2-[[(E)-1-amyl-10-hydroxy-dec-2-enyl]amino]-3-mercapto-propionic acid Formula: C18H35NO3S MolecularWeight: 345.5404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CCCCCCCCO)NC(CS)C(=O)O

Isomeric SMILES

CCCCCC(/C=C/CCCCCCCO)NC(CS)C(=O)O

InChI

InChI=1S/C18H35NO3S/c1-2-3-9-12-16(19-17(15-23)18(21)22)13-10-7-5-4-6-8-11-14-20/h10,13,16-17,19-20,23H,2-9,11-12,14-15H2,1H3,(H,21,22)/b13-10+