Molecule ID: 71581200

IUPAC Name: N-[(2S,3R)-1,3-dihydroxy-15-methylhexadecan-2-yl]heptadecanamide

Description: The molecule is a N-acyl-15-methylhexadecasphinganine in which the acyl group has 17 carbons and 0 double bonds. It is a N-acyl-15-methylhexadecasphinganine and a Cer(d34:0).

SMILES: CCCCCCCCCCCCCCCCC(O)=N[C@@H](CO)[C@H](O)CCCCCCCCCCCC(C)C

SELFIES: [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][Branch1][C][O][=N][C@@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][O][C][C][C][C][C][C][C][C][C][C][C][C][Branch1][C][C][C]

InChI: InChI=1S/C34H69NO3/c1-4-5-6-7-8-9-10-11-12-13-17-20-23-26-29-34(38)35-32(30-36)33(37)28-25-22-19-16-14-15-18-21-24-27-31(2)3/h31-33,36-37H,4-30H2,1-3H3,(H,35,38)/t32-,33+/m0/s1

Molecular Properties:
- Polar Surface Area: 69.6 Ų
- LogP: 13.1