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methyl 2-octadecanoylhexacosanoate

methyl 2-octadecanoylhexacosanoate

Systemtic Name:methyl 2-octadecanoylhexacosanoate
Openeye Name:methyl 2-octadecanoylhexacosanoate
CAS Name:2-(1-oxooctadecyl)hexacosanoic acid methyl ester
IUPAC Name:methyl 2-octadecanoylhexacosanoate
Traditional Name:2-stearoylcerotic acid methyl ester
Formula: C45H88O3
MolecularWeight: 677.17842
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)CCCCCCCCCCCCCCCCC)C(=O)OC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)CCCCCCCCCCCCCCCCC)C(=O)OC


InChI

InChI=1S/C45H88O3/c1-4-6-8-10-12-14-16-18-20-21-22-23-24-25-26-28-29-31-33-35-37-39-41-43(45(47)48-3)44(46)42-40-38-36-34-32-30-27-19-17-15-13-11-9-7-5-2/h43H,4-42H2,1-3H3


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