9-(1-octadecanoyloxy-3-oxidanyl-propan-2-yl)oxy-9-oxidanylidene-nonanoic acid

Systemtic Name: 9-(1-octadecanoyloxy-3-oxidanyl-propan-2-yl)oxy-9-oxidanylidene-nonanoic acid Openeye Name: 9-[1-(hydroxymethyl)-2-octadecanoyloxy-ethoxy]-9-oxo-nonanoic acid CAS Name: 9-[1-hydroxy-3-(1-oxooctadecoxy)propan-2-yl]oxy-9-oxononanoic acid IUPAC Name: 9-(1-hydroxy-3-octadecanoyloxypropan-2-yl)oxy-9-oxononanoic acid Traditional Name: 9-keto-9-(1-methylol-2-stearoyloxy-ethoxy)pelargonic acid Formula: C30H56O7 MolecularWeight: 528.76144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC(=O)O

InChI

InChI=1S/C30H56O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23-29(34)36-26-27(25-31)37-30(35)24-21-18-15-16-19-22-28(32)33/h27,31H,2-26H2,1H3,(H,32,33)