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4-[(E)-16-(4-oxidanylcyclohexyl)hexadec-14-enyl]sulfanylbutanoic acid

4-[(E)-16-(4-oxidanylcyclohexyl)hexadec-14-enyl]sulfanylbutanoic acid

Systemtic Name:4-[(E)-16-(4-oxidanylcyclohexyl)hexadec-14-enyl]sulfanylbutanoic acid
Openeye Name:4-[(E)-16-(4-hydroxycyclohexyl)hexadec-14-enyl]sulfanylbutanoic acid
CAS Name:4-[[(E)-16-(4-hydroxycyclohexyl)hexadec-14-enyl]thio]butanoic acid
IUPAC Name:4-[(E)-16-(4-hydroxycyclohexyl)hexadec-14-enyl]sulfanylbutanoic acid
Traditional Name:4-[[(E)-16-(4-hydroxycyclohexyl)hexadec-14-enyl]thio]butyric acid
Formula: C26H48O3S
MolecularWeight: 440.72252
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC=CCCCCCCCCCCCCCSCCCC(=O)O)O


Isomeric SMILES

C1CC(CCC1C/C=C/CCCCCCCCCCCCCSCCCC(=O)O)O


InChI

InChI=1S/C26H48O3S/c27-25-20-18-24(19-21-25)16-13-11-9-7-5-3-1-2-4-6-8-10-12-14-22-30-23-15-17-26(28)29/h11,13,24-25,27H,1-10,12,14-23H2,(H,28,29)/b13-11+


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