(E)-2-(2-carboxyethylsulfanylmethyl)icos-11-enoic acid

Systemtic Name: (E)-2-(2-carboxyethylsulfanylmethyl)icos-11-enoic acid Openeye Name: (E)-2-(2-carboxyethylsulfanylmethyl)icos-11-enoic acid CAS Name: (E)-2-[(2-carboxyethylthio)methyl]-11-eicosenoic acid IUPAC Name: (E)-2-(2-carboxyethylsulfanylmethyl)icos-11-enoic acid Traditional Name: (E)-2-[(2-carboxyethylthio)methyl]eicos-11-enoic acid Formula: C24H44O4S MolecularWeight: 428.66876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCC(CSCCC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCC(CSCCC(=O)O)C(=O)O

InChI

InChI=1S/C24H44O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24(27)28)21-29-20-19-23(25)26/h9-10,22H,2-8,11-21H2,1H3,(H,25,26)(H,27,28)/b10-9+