2-[[6-tert-butyl-3,4,5-tris(oxidanyl)oxan-2-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[6-tert-butyl-3,4,5-tris(oxidanyl)oxan-2-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[(6-tert-butyl-3,4,5-trihydroxy-tetrahydropyran-2-yl)methylsulfanyl]acetic acid CAS Name: 2-[(6-tert-butyl-3,4,5-trihydroxy-2-oxanyl)methylthio]acetic acid IUPAC Name: 2-[(6-tert-butyl-3,4,5-trihydroxyoxan-2-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(6-tert-butyl-3,4,5-trihydroxy-tetrahydropyran-2-yl)methylthio]acetic acid Formula: C12H22O6S MolecularWeight: 294.36448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C(C(C(C(O1)CSCC(=O)O)O)O)O

Isomeric SMILES

CC(C)(C)C1C(C(C(C(O1)CSCC(=O)O)O)O)O

InChI

InChI=1S/C12H22O6S/c1-12(2,3)11-10(17)9(16)8(15)6(18-11)4-19-5-7(13)14/h6,8-11,15-17H,4-5H2,1-3H3,(H,13,14)