[3,4,5-tri(dodecanoyloxy)-6-(3-oxidanylidenecyclopentyl)sulfanyl-oxan-2-yl]methyl dodecanoate

Systemtic Name: [3,4,5-tri(dodecanoyloxy)-6-(3-oxidanylidenecyclopentyl)sulfanyl-oxan-2-yl]methyl dodecanoate Openeye Name: [3,4,5-tri(dodecanoyloxy)-6-(3-oxocyclopentyl)sulfanyl-tetrahydropyran-2-yl]methyl dodecanoate CAS Name: dodecanoic acid [6-[(3-oxocyclopentyl)thio]-3,4,5-tris(1-oxododecoxy)-2-oxanyl]methyl ester IUPAC Name: [3,4,5-tri(dodecanoyloxy)-6-(3-oxocyclopentyl)sulfanyloxan-2-yl]methyl dodecanoate Traditional Name: lauric acid [6-[(3-ketocyclopentyl)thio]-3,4,5-trilauroyloxy-tetrahydropyran-2-yl]methyl ester Formula: C59H106O10S MolecularWeight: 1007.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)SC2CCC(=O)C2)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)SC2CCC(=O)C2)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC

InChI

InChI=1S/C59H106O10S/c1-5-9-13-17-21-25-29-33-37-41-52(61)65-48-51-56(67-53(62)42-38-34-30-26-22-18-14-10-6-2)57(68-54(63)43-39-35-31-27-23-19-15-11-7-3)58(59(66-51)70-50-46-45-49(60)47-50)69-55(64)44-40-36-32-28-24-20-16-12-8-4/h50-51,56-59H,5-48H2,1-4H3