2-[2-[[(E)-octadec-9-enoyl]amino]hexadecanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[2-[[(E)-octadec-9-enoyl]amino]hexadecanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[2-[[(E)-octadec-9-enoyl]amino]hexadecanoylamino]propanoic acid CAS Name: 3-hydroxy-2-[[1-oxo-2-[[(E)-1-oxooctadec-9-enyl]amino]hexadecyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[2-[[(E)-octadec-9-enoyl]amino]hexadecanoylamino]propanoic acid Traditional Name: 3-hydroxy-2-[2-[[(E)-octadec-9-enoyl]amino]hexadecanoylamino]propionic acid Formula: C37H70N2O5 MolecularWeight: 622.9621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(=O)NC(CO)C(=O)O)NC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCC(C(=O)NC(CO)C(=O)O)NC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C37H70N2O5/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-35(41)38-33(36(42)39-34(32-40)37(43)44)30-28-26-24-22-20-16-14-12-10-8-6-4-2/h17-18,33-34,40H,3-16,19-32H2,1-2H3,(H,38,41)(H,39,42)(H,43,44)/b18-17+