Chem
J-GLOBAL ID：200907077279683660   Nikkaji number：J1.767.704G

N-[1-(1-Phenyl-2-deoxy-1-thio-α-D-galactopyranose-2-yl)-1H-1,2,3-triazole-4-ylcarbonyl]-Phe-Gly-Phe-Gly-OH ester

N-[1-(1-フェニル-2-デオキシ-1-チオ-α-D-ガラクトピラノース-2-イル)-1H-1,2,3-トリアゾール-4-イルカルボニル]-Phe-Gly-Phe-Gly-OH
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： C37H41N7O10S
Molecular formula furigana： C37-H41-N7-O10-S
Molecular weight： 775.830
InChI： InChI=1S/C37H41N7O10S/c45-21-28-31(49)32(50)33(37(55,54-28)24-14-8-3-9-15-24)44-20-27(42-43-44)36(53)41-26(17-23-12-6-2-7-13-23)35(52)38-18-29(46)40-25(34(51)39-19-30(47)48)16-22-10-4-1-5-11-22/h1-15,20,25-26,28,31-33,45,49-50,55H,16-19,21H2,(H,38,52)(H,39,51)(H,40,46)(H,41,53)(H,47,48)/t25-,26-,28+,31-,32-,33+,37+/m0/s1
InChI key： XLAXDWSWODENHJ-JLXUHALRSA-N
SMILES： OC[C@H]1O[C@](S)([C@@H]([C@@H](O)[C@H]1O)n1cc(nn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O)c1ccccc1
Systematic name  (3)：
  • N-[1-(1-フェニル-2-デオキシ-1-チオ-α-D-ガラクトピラノース-2-イル)-1H-1,2,3-トリアゾール-4-イルカルボニル]-Phe-Gly-Phe-Gly-OH
  • 2-[(2S)-2-{2-[(2S)-2-({1-[(2R,3R,4R,5R,6R)-4,5-ジヒドロキシ-6-(ヒドロキシメチル)-2-フェニル-2-スルファニルオキサン-3-イル]-1H-1,2,3-トリアゾール-4-イル}ホルムアミド)-3-フェニルプロパンアミド]アセトアミド}-3-フェニルプロパンアミド]酢酸
  • 2-[(2S)-2-{2-[(2S)-2-({1-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-phenyl-2-sulfanyloxan-3-yl]-1H-1,2,3-triazol-4-yl}formamido)-3-phenylpropanamido]acetamido}-3-phenylpropanamido]acetic acid
Other name (1)：
  • N-[1-(1-Phenyl-2-deoxy-1-thio-α-D-galactopyranose-2-yl)-1H-1,2,3-triazole-4-ylcarbonyl]-Phe-Gly-Phe-Gly-OH ester
Thsaurus map：
Thesaurus Map

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