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18-oxidanylidenepentacontanoic acid

18-oxidanylidenepentacontanoic acid

Systemtic Name:18-oxidanylidenepentacontanoic acid
Openeye Name:18-oxopentacontanoic acid
CAS Name:18-oxopentacontanoic acid
IUPAC Name:18-oxopentacontanoic acid
Traditional Name:18-ketopentacontanoic acid
Formula: C50H98O3
MolecularWeight: 747.31132
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCCC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCCC(=O)O


InChI

InChI=1S/C50H98O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-28-31-34-37-40-43-46-49(51)47-44-41-38-35-32-29-26-27-30-33-36-39-42-45-48-50(52)53/h2-48H2,1H3,(H,52,53)


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