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12-hexyl-13-oxidanylidene-tetratriacontanoic acid

12-hexyl-13-oxidanylidene-tetratriacontanoic acid

Systemtic Name:12-hexyl-13-oxidanylidene-tetratriacontanoic acid
Openeye Name:12-hexyl-13-oxo-tetratriacontanoic acid
CAS Name:12-hexyl-13-oxotetratriacontanoic acid
IUPAC Name:12-hexyl-13-oxotetratriacontanoic acid
Traditional Name:12-hexyl-13-keto-geddic acid
Formula: C40H78O3
MolecularWeight: 607.04552
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)C(CCCCCC)CCCCCCCCCCC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)C(CCCCCC)CCCCCCCCCCC(=O)O


InChI

InChI=1S/C40H78O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-25-28-32-36-39(41)38(34-30-8-6-4-2)35-31-27-24-22-23-26-29-33-37-40(42)43/h38H,3-37H2,1-2H3,(H,42,43)


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