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4-docosylsulfanylpentanoic acid

4-docosylsulfanylpentanoic acid

Systemtic Name:4-docosylsulfanylpentanoic acid
Openeye Name:4-docosylsulfanylpentanoic acid
CAS Name:4-(docosylthio)pentanoic acid
IUPAC Name:4-docosylsulfanylpentanoic acid
Traditional Name:4-(behenylthio)valeric acid
Formula: C27H54O2S
MolecularWeight: 442.78146
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCSC(C)CCC(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCSC(C)CCC(=O)O


InChI

InChI=1S/C27H54O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-30-26(2)23-24-27(28)29/h26H,3-25H2,1-2H3,(H,28,29)


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