(3S,6R)-2,2,6-trimethyl-6-(2-oxidanylpropan-2-yl)oxane-3-carboxylic acid

Systemtic Name: (3S,6R)-2,2,6-trimethyl-6-(2-oxidanylpropan-2-yl)oxane-3-carboxylic acid Openeye Name: (3S,6R)-6-(1-hydroxy-1-methyl-ethyl)-2,2,6-trimethyl-tetrahydropyran-3-carboxylic acid CAS Name: (3S,6R)-6-(2-hydroxypropan-2-yl)-2,2,6-trimethyl-3-oxanecarboxylic acid IUPAC Name: (3S,6R)-6-(2-hydroxypropan-2-yl)-2,2,6-trimethyloxane-3-carboxylic acid Traditional Name: (3S,6R)-6-(1-hydroxy-1-methyl-ethyl)-2,2,6-trimethyl-tetrahydropyran-3-carboxylic acid Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC(O1)(C)C(C)(C)O)C(=O)O)C

Isomeric SMILES

C[C@@]1(CC[C@@H](C(O1)(C)C)C(=O)O)C(C)(C)O

InChI

InChI=1S/C12H22O4/c1-10(2)8(9(13)14)6-7-12(5,16-10)11(3,4)15/h8,15H,6-7H2,1-5H3,(H,13,14)/t8-,12-/m1/s1