3-[2,3-bis(oxidanyl)propanoyloxycarbonyl]-5-octadecoxy-3-oxidanyl-5-oxidanylidene-pentanoate

Systemtic Name: 3-[2,3-bis(oxidanyl)propanoyloxycarbonyl]-5-octadecoxy-3-oxidanyl-5-oxidanylidene-pentanoate Openeye Name: 3-(2,3-dihydroxypropanoyloxycarbonyl)-3-hydroxy-5-octadecoxy-5-oxo-pentanoate CAS Name: 3-[(2,3-dihydroxy-1-oxopropoxy)-oxomethyl]-3-hydroxy-5-octadecoxy-5-oxopentanoate IUPAC Name: 3-(2,3-dihydroxypropanoyloxycarbonyl)-3-hydroxy-5-octadecoxy-5-oxopentanoate Traditional Name: 3-glyceroyloxycarbonyl-3-hydroxy-5-keto-5-stearyloxy-valerate Formula: C27H47O10- MolecularWeight: 531.65608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CC(CC(=O)[O-])(C(=O)OC(=O)C(CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CC(CC(=O)[O-])(C(=O)OC(=O)C(CO)O)O

InChI

InChI=1S/C27H48O10/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-36-24(32)20-27(35,19-23(30)31)26(34)37-25(33)22(29)21-28/h22,28-29,35H,2-21H2,1H3,(H,30,31)/p-1