6-[2-(hydroxymethyl)-2-(octadecanoyloxymethyl)-3-(4-oxidanidyl-3-oxidanyl-4-oxidanylidene-butanoyl)oxy-propoxy]-6-oxidanylidene-hexanoate

Systemtic Name: 6-[2-(hydroxymethyl)-2-(octadecanoyloxymethyl)-3-(4-oxidanidyl-3-oxidanyl-4-oxidanylidene-butanoyl)oxy-propoxy]-6-oxidanylidene-hexanoate Openeye Name: 6-[2-(hydroxymethyl)-2-[(3-hydroxy-4-oxido-4-oxo-butanoyl)oxymethyl]-3-octadecanoyloxy-propoxy]-6-oxo-hexanoate CAS Name: 6-[2-(hydroxymethyl)-2-[(3-hydroxy-4-oxido-1,4-dioxobutoxy)methyl]-3-(1-oxooctadecoxy)propoxy]-6-oxohexanoate IUPAC Name: 6-[2-(hydroxymethyl)-2-[(3-hydroxy-4-oxido-4-oxobutanoyl)oxymethyl]-3-octadecanoyloxypropoxy]-6-oxohexanoate Traditional Name: 6-[2-[(3-hydroxy-4-keto-4-oxido-butanoyl)oxymethyl]-2-methylol-3-stearoyloxy-propoxy]-6-keto-hexanoate Formula: C33H56O12-2 MolecularWeight: 644.79054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)(COC(=O)CCCCC(=O)[O-])COC(=O)CC(C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)(COC(=O)CCCCC(=O)[O-])COC(=O)CC(C(=O)[O-])O

InChI

InChI=1S/C33H58O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-29(38)43-24-33(23-34,26-45-31(40)22-27(35)32(41)42)25-44-30(39)21-18-17-19-28(36)37/h27,34-35H,2-26H2,1H3,(H,36,37)(H,41,42)/p-2