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3,4-bis(ethoxycarbonyl)-3,16-bis(oxidanyl)hexadecanoic acid; propane-1,2-diol

3,4-bis(ethoxycarbonyl)-3,16-bis(oxidanyl)hexadecanoic acid; propane-1,2-diol

Systemtic Name:3,4-bis(ethoxycarbonyl)-3,16-bis(oxidanyl)hexadecanoic acid; propane-1,2-diol
Openeye Name:3,4-bis(ethoxycarbonyl)-3,16-dihydroxy-hexadecanoic acid; propane-1,2-diol
CAS Name:3,4-bis(ethoxycarbonyl)-3,16-dihydroxyhexadecanoic acid; propane-1,2-diol
IUPAC Name:3,4-bis(ethoxycarbonyl)-3,16-dihydroxyhexadecanoic acid; propane-1,2-diol
Traditional Name:3,4-dicarbethoxy-3,16-dihydroxy-palmitic acid; propane-1,2-diol
Formula: C25H48O10
MolecularWeight: 508.64262
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCCCCCCCCO)C(CC(=O)O)(C(=O)OCC)O.CC(CO)O


Isomeric SMILES

CCOC(=O)C(CCCCCCCCCCCCO)C(CC(=O)O)(C(=O)OCC)O.CC(CO)O


InChI

InChI=1S/C22H40O8.C3H8O2/c1-3-29-20(26)18(22(28,17-19(24)25)21(27)30-4-2)15-13-11-9-7-5-6-8-10-12-14-16-23;1-3(5)2-4/h18,23,28H,3-17H2,1-2H3,(H,24,25);3-5H,2H2,1H3


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