[(2R)-3-oxidanyl-2-[(Z,12R)-12-oxidanyloctadec-9-enoyl]oxy-propyl] (Z,12R)-12-oxidanyloctadec-9-enoate

Systemtic Name: [(2R)-3-oxidanyl-2-[(Z,12R)-12-oxidanyloctadec-9-enoyl]oxy-propyl] (Z,12R)-12-oxidanyloctadec-9-enoate Openeye Name: [(2R)-3-hydroxy-2-[(Z,12R)-12-hydroxyoctadec-9-enoyl]oxy-propyl] (Z,12R)-12-hydroxyoctadec-9-enoate CAS Name: (Z,12R)-12-hydroxy-9-octadecenoic acid [(2R)-3-hydroxy-2-[(Z,12R)-12-hydroxy-1-oxooctadec-9-enoxy]propyl] ester IUPAC Name: [(2R)-3-hydroxy-2-[(Z,12R)-12-hydroxyoctadec-9-enoyl]oxypropyl] (Z,12R)-12-hydroxyoctadec-9-enoate Traditional Name: (Z,12R)-12-hydroxyoctadec-9-enoic acid [(2R)-3-hydroxy-2-[(Z,12R)-12-hydroxyoctadec-9-enoyl]oxy-propyl] ester Formula: C39H72O7 MolecularWeight: 652.98478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCC=CCC(CCCCCC)O)O

Isomeric SMILES

CCCCCC[C@H](C/C=C\CCCCCCCC(=O)OC[C@@H](CO)OC(=O)CCCCCCC/C=C\C[C@@H](CCCCCC)O)O

InChI

InChI=1S/C39H72O7/c1-3-5-7-21-27-35(41)29-23-17-13-9-11-15-19-25-31-38(43)45-34-37(33-40)46-39(44)32-26-20-16-12-10-14-18-24-30-36(42)28-22-8-6-4-2/h17-18,23-24,35-37,40-42H,3-16,19-22,25-34H2,1-2H3/b23-17-,24-18-/t35-,36-,37-/m1/s1