5-[(2S,4R)-2-[(1R,2R,3S)-1,2,3,4-tetrakis(oxidanyl)butyl]-1,3-dithian-4-yl]pentanoic acid

Systemtic Name: 5-[(2S,4R)-2-[(1R,2R,3S)-1,2,3,4-tetrakis(oxidanyl)butyl]-1,3-dithian-4-yl]pentanoic acid Openeye Name: 5-[(2S,4R)-2-[(1R,2R,3S)-1,2,3,4-tetrahydroxybutyl]-1,3-dithian-4-yl]pentanoic acid CAS Name: 5-[(2S,4R)-2-[(1R,2R,3S)-1,2,3,4-tetrahydroxybutyl]-1,3-dithian-4-yl]pentanoic acid IUPAC Name: 5-[(2S,4R)-2-[(1R,2R,3S)-1,2,3,4-tetrahydroxybutyl]-1,3-dithian-4-yl]pentanoic acid Traditional Name: 5-[(2S,4R)-2-[(1R,2R,3S)-1,2,3,4-tetrahydroxybutyl]-1,3-dithian-4-yl]valeric acid Formula: C13H24O6S2 MolecularWeight: 340.45606

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1CCCCC(=O)O)C(C(C(CO)O)O)O

Isomeric SMILES

C1CS[C@@H](S[C@@H]1CCCCC(=O)O)[C@@H]([C@@H]([C@H](CO)O)O)O

InChI

InChI=1S/C13H24O6S2/c14-7-9(15)11(18)12(19)13-20-6-5-8(21-13)3-1-2-4-10(16)17/h8-9,11-15,18-19H,1-7H2,(H,16,17)/t8-,9+,11-,12-,13+/m1/s1