(3S)-3-[(3S)-3-[(3S)-3-oxidanylbutanoyl]oxybutanoyl]oxybutanoic acid

Systemtic Name: (3S)-3-[(3S)-3-[(3S)-3-oxidanylbutanoyl]oxybutanoyl]oxybutanoic acid Openeye Name: (3S)-3-[(3S)-3-[(3S)-3-hydroxybutanoyl]oxybutanoyl]oxybutanoic acid CAS Name: (3S)-3-[(3S)-3-[(3S)-3-hydroxy-1-oxobutoxy]-1-oxobutoxy]butanoic acid IUPAC Name: (3S)-3-[(3S)-3-[(3S)-3-hydroxybutanoyl]oxybutanoyl]oxybutanoic acid Traditional Name: (3S)-3-[(3S)-3-[(3S)-3-hydroxybutanoyl]oxybutanoyl]oxybutyric acid Formula: C12H20O7 MolecularWeight: 276.283

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)CC(=O)OC(C)CC(=O)O)O

Isomeric SMILES

C[C@@H](CC(=O)O[C@@H](C)CC(=O)O[C@@H](C)CC(=O)O)O

InChI

InChI=1S/C12H20O7/c1-7(13)4-11(16)19-9(3)6-12(17)18-8(2)5-10(14)15/h7-9,13H,4-6H2,1-3H3,(H,14,15)/t7-,8-,9-/m0/s1