[6-(hydroxymethyl)-2-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl] octadecanoate

Systemtic Name: [6-(hydroxymethyl)-2-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl] octadecanoate Openeye Name: [4,5-dihydroxy-6-(hydroxymethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl] octadecanoate CAS Name: octadecanoic acid [4,5-dihydroxy-6-(hydroxymethyl)-2-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-3-oxanyl] ester IUPAC Name: [4,5-dihydroxy-6-(hydroxymethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] octadecanoate Traditional Name: stearic acid [4,5-dihydroxy-6-methylol-2-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-tetrahydropyran-3-yl] ester Formula: C30H56O12 MolecularWeight: 608.75844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1OC2C(C(C(C(O2)CO)O)O)O)CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1C(C(C(OC1OC2C(C(C(C(O2)CO)O)O)O)CO)O)O

InChI

InChI=1S/C30H56O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(33)41-28-26(37)24(35)21(19-32)40-30(28)42-29-27(38)25(36)23(34)20(18-31)39-29/h20-21,23-32,34-38H,2-19H2,1H3