[6-(hydroxymethyl)-4,5-bis(oxidanyl)-2-[1,2,4,5,6-pentakis(oxidanyl)hexan-3-yloxy]oxan-3-yl] dodecanoate

Systemtic Name: [6-(hydroxymethyl)-4,5-bis(oxidanyl)-2-[1,2,4,5,6-pentakis(oxidanyl)hexan-3-yloxy]oxan-3-yl] dodecanoate Openeye Name: [2-[1-(1,2-dihydroxyethyl)-2,3,4-trihydroxy-butoxy]-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] dodecanoate CAS Name: dodecanoic acid [4,5-dihydroxy-6-(hydroxymethyl)-2-(1,2,4,5,6-pentahydroxyhexan-3-yloxy)-3-oxanyl] ester IUPAC Name: [4,5-dihydroxy-6-(hydroxymethyl)-2-(1,2,4,5,6-pentahydroxyhexan-3-yloxy)oxan-3-yl] dodecanoate Traditional Name: lauric acid [2-[1-(1,2-dihydroxyethyl)-2,3,4-trihydroxy-butoxy]-4,5-dihydroxy-6-methylol-tetrahydropyran-3-yl] ester Formula: C24H46O12 MolecularWeight: 526.61484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1C(C(C(OC1OC(C(CO)O)C(C(CO)O)O)CO)O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1C(C(C(OC1OC(C(CO)O)C(C(CO)O)O)CO)O)O

InChI

InChI=1S/C24H46O12/c1-2-3-4-5-6-7-8-9-10-11-18(30)35-23-21(33)20(32)17(14-27)34-24(23)36-22(16(29)13-26)19(31)15(28)12-25/h15-17,19-29,31-33H,2-14H2,1H3