dodecanoic acid; propane-1,2,3-triol

Systemtic Name: dodecanoic acid; propane-1,2,3-triol Openeye Name: dodecanoic acid; glycerol CAS Name: dodecanoic acid; propane-1,2,3-triol IUPAC Name: dodecanoic acid; propane-1,2,3-triol Traditional Name: glycerol; lauric acid Formula: C42H104O32 MolecularWeight: 1121.25596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O.C(C(CO)O)O

InChI

InChI=1S/C12H24O2.10C3H8O3/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;10*4-1-3(6)2-5/h2-11H2,1H3,(H,13,14);10*3-6H,1-2H2