[(2S,3R,4R,5S,6R)-6-[[(2R,3S)-4-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl] 3-methylbutanoate

Systemtic Name: [(2S,3R,4R,5S,6R)-6-[[(2R,3S)-4-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl] 3-methylbutanoate Openeye Name: [(2S,3R,4R,5S,6R)-6-[[(2R,3S)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]oxymethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [(2S,3R,4R,5S,6R)-6-[[(2R,3S)-3,4-dihydroxy-4-(hydroxymethyl)-2-oxolanyl]oxymethyl]-3,4,5-trihydroxy-2-oxanyl] ester IUPAC Name: [(2S,3R,4R,5S,6R)-6-[[(2R,3S)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [(2S,3R,4R,5S,6R)-6-[[(2R,3S)-3,4-dihydroxy-4-methylol-tetrahydrofuran-2-yl]oxymethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl] ester Formula: C16H28O11 MolecularWeight: 396.38692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OC1C(C(C(C(O1)COC2C(C(CO2)(CO)O)O)O)O)O

Isomeric SMILES

CC(C)CC(=O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO[C@H]2[C@H](C(CO2)(CO)O)O)O)O)O

InChI

InChI=1S/C16H28O11/c1-7(2)3-9(18)27-14-12(21)11(20)10(19)8(26-14)4-24-15-13(22)16(23,5-17)6-25-15/h7-8,10-15,17,19-23H,3-6H2,1-2H3/t8-,10-,11-,12-,13-,14+,15-,16?/m1/s1