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

Systemtic Name: 2-[[6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methylsulfanyl]-2-phenyl-ethanoic acid Openeye Name: 2-phenyl-2-[(3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methylsulfanyl]acetic acid CAS Name: 2-phenyl-2-[(3,4,5-trihydroxy-6-methoxy-2-oxanyl)methylthio]acetic acid IUPAC Name: 2-phenyl-2-[(3,4,5-trihydroxy-6-methoxyoxan-2-yl)methylsulfanyl]acetic acid Traditional Name: 2-phenyl-2-[(3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methylthio]acetic acid Formula: C15H20O7S MolecularWeight: 344.3801

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(C(C(O1)CSC(C2=CC=CC=C2)C(=O)O)O)O)O

Isomeric SMILES

COC1C(C(C(C(O1)CSC(C2=CC=CC=C2)C(=O)O)O)O)O

InChI

InChI=1S/C15H20O7S/c1-21-15-12(18)11(17)10(16)9(22-15)7-23-13(14(19)20)8-5-3-2-4-6-8/h2-6,9-13,15-18H,7H2,1H3,(H,19,20)