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9-oxidanyloctadecyl docosanoate

9-oxidanyloctadecyl docosanoate

Systemtic Name:9-oxidanyloctadecyl docosanoate
Openeye Name:9-hydroxyoctadecyl docosanoate
CAS Name:docosanoic acid 9-hydroxyoctadecyl ester
IUPAC Name:9-hydroxyoctadecyl docosanoate
Traditional Name:behenic acid 9-hydroxyoctadecyl ester
Formula: C40H80O3
MolecularWeight: 609.0614
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCC(CCCCCCCCC)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCC(CCCCCCCCC)O


InChI

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


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