2,3-diacetyloxy-4-(3-hexadecanoyloxy-2-oxidanyl-propoxy)-4-oxidanylidene-butanoic acid

Systemtic Name: 2,3-diacetyloxy-4-(3-hexadecanoyloxy-2-oxidanyl-propoxy)-4-oxidanylidene-butanoic acid Openeye Name: 2,3-diacetoxy-4-(3-hexadecanoyloxy-2-hydroxy-propoxy)-4-oxo-butanoic acid CAS Name: 2,3-diacetyloxy-4-[2-hydroxy-3-(1-oxohexadecoxy)propoxy]-4-oxobutanoic acid IUPAC Name: 2,3-diacetyloxy-4-(3-hexadecanoyloxy-2-hydroxypropoxy)-4-oxobutanoic acid Traditional Name: 2,3-diacetoxy-4-(3-hexadecanoyloxy-2-hydroxy-propoxy)-4-keto-butyric acid Formula: C27H46O11 MolecularWeight: 546.64754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C(C(C(=O)O)OC(=O)C)OC(=O)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)C(C(C(=O)O)OC(=O)C)OC(=O)C)O

InChI

InChI=1S/C27H46O11/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(31)35-18-22(30)19-36-27(34)25(38-21(3)29)24(26(32)33)37-20(2)28/h22,24-25,30H,4-19H2,1-3H3,(H,32,33)