Chem
J-GLOBAL ID:200907042798791685   Nikkaji number:J2.691.329B

N-(2-O,3-O,4-O,5-O,6-O-Pentaacetyl-D-glucose-1-yl)-L-methionine methyl ester

N-(2-O,3-O,4-O,5-O,6-O-ペンタアセチル-D-グルコース-1-イル)-L-メチオニンメチル
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: C22H33NO13S
Molecular formula furigana: C22-H33-N-O13-S
Molecular weight: 551.560
InChI: InChI=1S/C22H33NO13S/c1-11(24)32-10-17(33-12(2)25)18(34-13(3)26)19(35-14(4)27)20(36-15(5)28)21(29)23-16(8-9-37-7)22(30)31-6/h16-20H,8-10H2,1-7H3,(H,23,29)/t16-,17+,18+,19-,20+/m0/s1
InChI key: AFEXIBJABQJQMP-MFKWGIFDSA-N
SMILES: COC(=O)[C@H](CCSC)NC(=O)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@H](COC(=O)C)OC(=O)C
Systematic name  (3):
  • N-(2-O,3-O,4-O,5-O,6-O-ペンタアセチル-D-グルコース-1-イル)-L-メチオニンメチル
  • メチル (2S)-4-(メチルスルファニル)-2-[(2R,3S,4R,5R)-2,3,4,5,6-ペンタキス(アセチルオキシ)ヘキサンアミド]ブタノアート
  • methyl (2S)-4-(methylsulfanyl)-2-[(2R,3S,4R,5R)-2,3,4,5,6-pentakis(acetyloxy)hexanamido]butanoate
Other name (1):
  • N-(2-O,3-O,4-O,5-O,6-O-Pentaacetyl-D-glucose-1-yl)-L-methionine methyl ester
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