Chem
J-GLOBAL ID：200907000352399370   Nikkaji number：J2.110.141I

2-O,3-O,4-O,6-O-Tetraacetyl-β-D-glucopyranosylcarbamic acid (1S)-2β-isopropyl-5α-methylcyclohexane-1α-yl ester

2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシルカルバミド酸(1S)-2β-イソプロピル-5α-メチルシクロヘキサン-1α-イル
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： C25H39NO11
Molecular formula furigana： C25-H39-N-O11
Molecular weight： 529.583
InChI： InChI=1S/C25H39NO11/c1-12(2)18-9-8-13(3)10-19(18)37-25(31)26-24-23(35-17(7)30)22(34-16(6)29)21(33-15(5)28)20(36-24)11-32-14(4)27/h12-13,18-24H,8-11H2,1-7H3,(H,26,31)/t13-,18+,19-,20+,21+,22-,23+,24+/m0/s1
InChI key： FEUSPJNNVHDHKQ-JCNFPBKESA-N
SMILES： CC(C)[C@H]1CC[C@H](C)C[C@@H]1OC(=O)N[C@@H]1O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1OC(=O)C
Systematic name  (3)：
  • 2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシルカルバミド酸(1S)-2β-イソプロピル-5α-メチルシクロヘキサン-1α-イル
  • [(2R,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-[({[(1S,2R,5S)-5-メチル-2-(プロパン-2-イル)シクロヘキシル]オキシ}カルボニル)アミノ]オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[({[(1S,2R,5S)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}carbonyl)amino]oxan-2-yl]methyl acetate
Other name (1)：
  • 2-O,3-O,4-O,6-O-Tetraacetyl-β-D-glucopyranosylcarbamic acid (1S)-2β-isopropyl-5α-methylcyclohexane-1α-yl ester
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