[5-(dodecanoylamino)-2,3,4-tris(oxidanyl)-6-oxidanylidene-hexyl] dodecanoate

Systemtic Name: [5-(dodecanoylamino)-2,3,4-tris(oxidanyl)-6-oxidanylidene-hexyl] dodecanoate Openeye Name: [5-(dodecanoylamino)-2,3,4-trihydroxy-6-oxo-hexyl] dodecanoate CAS Name: dodecanoic acid [2,3,4-trihydroxy-6-oxo-5-(1-oxododecylamino)hexyl] ester IUPAC Name: [5-(dodecanoylamino)-2,3,4-trihydroxy-6-oxohexyl] dodecanoate Traditional Name: lauric acid [2,3,4-trihydroxy-6-keto-5-(lauroylamino)hexyl] ester Formula: C30H57NO7 MolecularWeight: 543.77608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(C=O)C(C(C(COC(=O)CCCCCCCCCCC)O)O)O

Isomeric SMILES

CCCCCCCCCCCC(=O)NC(C=O)C(C(C(COC(=O)CCCCCCCCCCC)O)O)O

InChI

InChI=1S/C30H57NO7/c1-3-5-7-9-11-13-15-17-19-21-27(34)31-25(23-32)29(36)30(37)26(33)24-38-28(35)22-20-18-16-14-12-10-8-6-4-2/h23,25-26,29-30,33,36-37H,3-22,24H2,1-2H3,(H,31,34)