[(3S,4R,5R)-4-methyl-1,5,6-tris(oxidanyl)hexan-3-yl] 2-oxidanylbutanoate

Systemtic Name: [(3S,4R,5R)-4-methyl-1,5,6-tris(oxidanyl)hexan-3-yl] 2-oxidanylbutanoate Openeye Name: [(1S,2R,3R)-3,4-dihydroxy-1-(2-hydroxyethyl)-2-methyl-butyl] 2-hydroxybutanoate CAS Name: 2-hydroxybutanoic acid [(3S,4R,5R)-1,5,6-trihydroxy-4-methylhexan-3-yl] ester IUPAC Name: [(3S,4R,5R)-1,5,6-trihydroxy-4-methylhexan-3-yl] 2-hydroxybutanoate Traditional Name: 2-hydroxybutyric acid [(1S,2R,3R)-3,4-dihydroxy-1-(2-hydroxyethyl)-2-methyl-butyl] ester Formula: C11H22O6 MolecularWeight: 250.28878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(CCO)C(C)C(CO)O)O

Isomeric SMILES

CCC(C(=O)O[C@@H](CCO)[C@H](C)[C@H](CO)O)O

InChI

InChI=1S/C11H22O6/c1-3-8(14)11(16)17-10(4-5-12)7(2)9(15)6-13/h7-10,12-15H,3-6H2,1-2H3/t7-,8?,9+,10+/m1/s1