hexane-1,2,3,4,5,6-hexol; 2-icosan-9-yl-2-[(2-icosan-9-yloxiran-2-yl)methoxymethyl]oxirane

Systemtic Name: hexane-1,2,3,4,5,6-hexol; 2-icosan-9-yl-2-[(2-icosan-9-yloxiran-2-yl)methoxymethyl]oxirane Openeye Name: hexane-1,2,3,4,5,6-hexol; 2-(1-octyldodecyl)-2-[[2-(1-octyldodecyl)oxiran-2-yl]methoxymethyl]oxirane CAS Name: 2-eicosan-9-yl-2-[(2-eicosan-9-yl-2-oxiranyl)methoxymethyl]oxirane; hexane-1,2,3,4,5,6-hexol IUPAC Name: hexane-1,2,3,4,5,6-hexol; 2-icosan-9-yl-2-[(2-icosan-9-yloxiran-2-yl)methoxymethyl]oxirane Traditional Name: hexane-1,2,3,4,5,6-hexol; 2-(1-octyldodecyl)-2-[[2-(1-octyldodecyl)oxiran-2-yl]methoxymethyl]oxirane Formula: C52H104O9 MolecularWeight: 873.37676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCCCCCC)C1(CO1)COCC2(CO2)C(CCCCCCCC)CCCCCCCCCCC.C(C(C(C(C(CO)O)O)O)O)O

Isomeric SMILES

CCCCCCCCCCCC(CCCCCCCC)C1(CO1)COCC2(CO2)C(CCCCCCCC)CCCCCCCCCCC.C(C(C(C(C(CO)O)O)O)O)O

InChI

InChI=1S/C46H90O3.C6H14O6/c1-5-9-13-17-21-23-25-29-33-37-43(35-31-27-19-15-11-7-3)45(41-48-45)39-47-40-46(42-49-46)44(36-32-28-20-16-12-8-4)38-34-30-26-24-22-18-14-10-6-2;7-1-3(9)5(11)6(12)4(10)2-8/h43-44H,5-42H2,1-4H3;3-12H,1-2H2