Chem
J-GLOBAL ID:200907003794486262   Nikkaji number:J2.414.740A

Fmoc-L-Phe-[(2R)-2-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-glucopyranosyl)-βAla-]-OBut

Fmoc-L-Phe-[(2R)-2-(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)-βAla-]-OBut
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: C45H52N2O14
Molecular formula furigana: C45-H52-N2-O14
Molecular weight: 844.911
InChI: InChI=1S/C45H52N2O14/c1-25(48)55-24-37-39(57-26(2)49)41(59-28(4)51)40(58-27(3)50)38(60-37)34(43(53)61-45(5,6)7)22-46-42(52)36(21-29-15-9-8-10-16-29)47-44(54)56-23-35-32-19-13-11-17-30(32)31-18-12-14-20-33(31)35/h8-20,34-41H,21-24H2,1-7H3,(H,46,52)(H,47,54)/t34-,36+,37-,38+,39-,40+,41+/m1/s1
InChI key: WHZGYTJOMVXUTD-TUDSJNHVSA-N
SMILES: CC(=O)OC[C@H]1O[C@@H]([C@@H](CNC(=O)[C@H](Cc2ccccc2)NC(=O)OCC2c3ccccc3c3ccccc23)C(=O)OC(C)(C)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C
Systematic name  (3):
  • Fmoc-L-Phe-[(2R)-2-(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)-βAla-]-OBut
  • tert-ブチル (2R)-3-[(2S)-2-({[(9H-フルオレン-9-イル)メトキシ]カルボニル}アミノ)-3-フェニルプロパンアミド]-2-[(2S,3S,4R,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-[(アセチルオキシ)メチル]オキサン-2-イル]プロパノアート
  • tert-butyl (2R)-3-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-phenylpropanamido]-2-[(2S,3S,4R,5R,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]propanoate
Other name (1):
  • Fmoc-L-Phe-[(2R)-2-(2-O,3-O,4-O,6-O-Tetraacetyl-β-D-glucopyranosyl)-βAla-]-OBut
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