(E,2S,3R)-2-[[(E)-heptadec-8-enyl]amino]octadec-4-ene-1,3-diol

Systemtic Name: (E,2S,3R)-2-[[(E)-heptadec-8-enyl]amino]octadec-4-ene-1,3-diol Openeye Name: (E,2S,3R)-2-[[(E)-heptadec-8-enyl]amino]octadec-4-ene-1,3-diol CAS Name: (E,2S,3R)-2-[[(E)-heptadec-8-enyl]amino]-4-octadecene-1,3-diol IUPAC Name: (E,2S,3R)-2-[[(E)-heptadec-8-enyl]amino]octadec-4-ene-1,3-diol Traditional Name: (E,2S,3R)-2-[[(E)-heptadec-8-enyl]amino]octadec-4-ene-1,3-diol Formula: C35H69NO2 MolecularWeight: 535.92786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CO)NCCCCCCCC=CCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)NCCCCCCC/C=C/CCCCCCCC)O

InChI

InChI=1S/C35H69NO2/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36-34(33-37)35(38)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,29,31,34-38H,3-16,19-28,30,32-33H2,1-2H3/b18-17+,31-29+/t34-,35+/m0/s1