11-decyl-13-ethanoyl-12-oxidanyl-tricosane-10,11,12-tricarboxylate

Systemtic Name: 11-decyl-13-ethanoyl-12-oxidanyl-tricosane-10,11,12-tricarboxylate Openeye Name: 11-acetyl-13-decyl-12-hydroxy-tricosane-10,11,12-tricarboxylate CAS Name: 11-acetyl-13-decyl-12-hydroxytricosane-10,11,12-tricarboxylate IUPAC Name: 11-acetyl-13-decyl-12-hydroxytricosane-10,11,12-tricarboxylate Traditional Name: 11-acetyl-13-decyl-12-hydroxy-tricosane-10,11,12-tricarboxylate Formula: C38H67O8-3 MolecularWeight: 651.93378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCCCC)(C(=O)[O-])C(C(=O)[O-])(C(CCCCCCCCCC)(C(=O)C)C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCCCC)(C(=O)[O-])C(C(=O)[O-])(C(CCCCCCCCCC)(C(=O)C)C(=O)[O-])O

InChI

InChI=1S/C38H70O8/c1-5-8-11-14-17-20-23-26-29-36(33(40)41,30-27-24-21-18-15-12-9-6-2)38(46,35(44)45)37(32(4)39,34(42)43)31-28-25-22-19-16-13-10-7-3/h46H,5-31H2,1-4H3,(H,40,41)(H,42,43)(H,44,45)/p-3