3-[dodecylsulfanyl(oxidanyl)methyl]-3,4-bis(oxidanyl)pentanoic acid

Systemtic Name: 3-[dodecylsulfanyl(oxidanyl)methyl]-3,4-bis(oxidanyl)pentanoic acid Openeye Name: 3-[dodecylsulfanyl(hydroxy)methyl]-3,4-dihydroxy-pentanoic acid CAS Name: 3-[(dodecylthio)-hydroxymethyl]-3,4-dihydroxypentanoic acid IUPAC Name: 3-[dodecylsulfanyl(hydroxy)methyl]-3,4-dihydroxypentanoic acid Traditional Name: 3,4-dihydroxy-3-[hydroxy-(laurylthio)methyl]valeric acid Formula: C18H36O5S MolecularWeight: 364.54044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C(CC(=O)O)(C(C)O)O)O

Isomeric SMILES

CCCCCCCCCCCCSC(C(CC(=O)O)(C(C)O)O)O

InChI

InChI=1S/C18H36O5S/c1-3-4-5-6-7-8-9-10-11-12-13-24-17(22)18(23,15(2)19)14-16(20)21/h15,17,19,22-23H,3-14H2,1-2H3,(H,20,21)