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docosyl 12-oxidanyloctadecanoate

docosyl 12-oxidanyloctadecanoate

Systemtic Name:docosyl 12-oxidanyloctadecanoate
Openeye Name:docosyl 12-hydroxyoctadecanoate
CAS Name:12-hydroxyoctadecanoic acid docosyl ester
IUPAC Name:docosyl 12-hydroxyoctadecanoate
Traditional Name:12-hydroxystearic acid behenyl ester
Formula: C40H80O3
MolecularWeight: 609.0614
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(CCCCCC)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC(CCCCCC)O


InChI

InChI=1S/C40H80O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-24-27-30-34-38-43-40(42)37-33-29-26-23-22-25-28-32-36-39(41)35-31-8-6-4-2/h39,41H,3-38H2,1-2H3


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