2-[2-[2-[3-[4-(carboxymethyl)-4-oxidanyl-6-oxidanylidene-oxan-2-yl]sulfanylpropylsulfanyl]ethyl]-4-oxidanyl-6-oxidanylidene-oxan-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-[3-[4-(carboxymethyl)-4-oxidanyl-6-oxidanylidene-oxan-2-yl]sulfanylpropylsulfanyl]ethyl]-4-oxidanyl-6-oxidanylidene-oxan-4-yl]ethanoic acid Openeye Name: 2-[2-[2-[3-[4-(carboxymethyl)-4-hydroxy-6-oxo-tetrahydropyran-2-yl]sulfanylpropylsulfanyl]ethyl]-4-hydroxy-6-oxo-tetrahydropyran-4-yl]acetic acid CAS Name: 2-[2-[2-[3-[[4-(carboxymethyl)-4-hydroxy-6-oxo-2-oxanyl]thio]propylthio]ethyl]-4-hydroxy-6-oxo-4-oxanyl]acetic acid IUPAC Name: 2-[2-[2-[3-[4-(carboxymethyl)-4-hydroxy-6-oxooxan-2-yl]sulfanylpropylsulfanyl]ethyl]-4-hydroxy-6-oxooxan-4-yl]acetic acid Traditional Name: 2-[2-[2-[3-[[4-(carboxymethyl)-4-hydroxy-6-keto-tetrahydropyran-2-yl]thio]propylthio]ethyl]-4-hydroxy-6-keto-tetrahydropyran-4-yl]acetic acid Formula: C19H28O10S2 MolecularWeight: 480.54962

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)CC1(CC(=O)O)O)CCSCCCSC2CC(CC(=O)O2)(CC(=O)O)O

Isomeric SMILES

C1C(OC(=O)CC1(CC(=O)O)O)CCSCCCSC2CC(CC(=O)O2)(CC(=O)O)O

InChI

InChI=1S/C19H28O10S2/c20-13(21)7-18(26)6-12(28-15(24)9-18)2-5-30-3-1-4-31-17-11-19(27,8-14(22)23)10-16(25)29-17/h12,17,26-27H,1-11H2,(H,20,21)(H,22,23)