Chem
J-GLOBAL ID：200907071427632584   Nikkaji number：J2.130.714I

1-(13C)Methyl-2-O,3-O:5-O,6-O-diisopropylidene-D-mannitol

1-(13C)メチル-2-O,3-O:5-O,6-O-ジイソプロピリデン-D-マンニトール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12[13C]H24O6
Molecular formula furigana： C13-H24-O6
Molecular weight： 277.321
InChI： InChI=1S/C13H24O6/c1-7(14)10-11(19-13(4,5)18-10)9(15)8-6-16-12(2,3)17-8/h7-11,14-15H,6H2,1-5H3/t7?,8-,9-,10-,11+/m1/s1/i1+1
InChI key： ZEXNDZMPBYAOLR-WMDDFLCASA-N
SMILES： CC1(C)OC[C@@H](O1)[C@@H](O)[C@@H]1OC(C)(C)O[C@@H]1C([13CH3])O
Systematic name  (3)：
  • 1-(13C)メチル-2-O,3-O:5-O,6-O-ジイソプロピリデン-D-マンニトール
  • 1-[(4S,5S)-5-[(R)-[(4R)-2,2-ジメチル-1,3-ジオキソラン-4-イル](ヒドロキシ)メチル]-2,2-ジメチル-1,3-ジオキソラン-4-イル](2-13C)エタン-1-オール
  • 1-[(4S,5S)-5-[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl](hydroxy)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl](2-13C)ethan-1-ol
Other name (1)：
  • 1-(13C)Methyl-2-O,3-O:5-O,6-O-diisopropylidene-D-mannitol
Thsaurus map：
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