Chem
J-GLOBAL ID:200907059885652969   Nikkaji number:J1.181.841B

N-(Benzyloxycarbonyl)-O-[2-O,3-O-diacetyl-4-O-[2-O,4-O,6-O-triacetyl-3-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-β-D-galactopyranosyl]-β-D-xylopyranosyl]-L-serine benzyl ester

N-(ベンジルオキシカルボニル)-O-[2-O,3-O-ジアセチル-4-O-[2-O,4-O,6-O-トリアセチル-3-O-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-β-D-ガラクトピラノシル]-β-D-キシロピラノシル]-L-セリンベンジル
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: C53H65NO28
Molecular formula furigana: C53-H65-N-O28
Molecular weight: 1164.082
InChI: InChI=1S/C53H65NO28/c1-26(55)66-23-38-41(72-28(3)57)44(75-31(6)60)47(77-33(8)62)52(81-38)82-45-42(73-29(4)58)39(24-67-27(2)56)79-51(48(45)78-34(9)63)80-40-25-70-50(46(76-32(7)61)43(40)74-30(5)59)69-22-37(49(64)68-20-35-16-12-10-13-17-35)54-53(65)71-21-36-18-14-11-15-19-36/h10-19,37-48,50-52H,20-25H2,1-9H3,(H,54,65)/t37-,38+,39+,40+,41-,42-,43-,44-,45-,46+,47+,48+,50+,51-,52-/m0/s1
InChI key: WZVYKPKYFJUPGQ-HTYFWDDUSA-N
SMILES: CC(=O)OC[C@H]1O[C@@H](O[C@@H]2CO[C@@H](OC[C@H](NC(=O)OCc3ccccc3)C(=O)OCc3ccccc3)[C@H](OC(=O)C)[C@H]2OC(=O)C)[C@H](OC(=O)C)[C@@H](O[C@@H]2O[C@H](COC(=O)C)[C@H](OC(=O)C)[C@H](OC(=O)C)[C@H]2OC(=O)C)[C@H]1OC(=O)C
Systematic name  (4):
  • N-(ベンジルオキシカルボニル)-O-[2-O,3-O-ジアセチル-4-O-[3-O-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-2-O,4-O,6-O-トリアセチル-β-D-ガラクトピラノシル]-β-D-キシロピラノシル]-L-セリンベンジル
  • N-(ベンジルオキシカルボニル)-O-[2-O,3-O-ジアセチル-4-O-[2-O,4-O,6-O-トリアセチル-3-O-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-ガラクトピラノシル)-β-D-ガラクトピラノシル]-β-D-キシロピラノシル]-L-セリンベンジル
  • ベンジル (2S)-2-{[(ベンジルオキシ)カルボニル]アミノ}-3-{[(2R,3R,4S,5R)-3,4-ビス(アセチルオキシ)-5-{[(2S,3R,4S,5S,6R)-3,5-ビス(アセチルオキシ)-6-[(アセチルオキシ)メチル]-4-{[(2S,3R,4S,5S,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]オキシ}オキサン-2-イル]オキシ}オキサン-2-イル]オキシ}プロパノアート
  • benzyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-{[(2R,3R,4S,5R)-3,4-bis(acetyloxy)-5-{[(2S,3R,4S,5S,6R)-3,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-4-{[(2S,3R,4S,5S,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl]oxy}oxan-2-yl]oxy}propanoate
Other name (2):
  • N-(Benzyloxycarbonyl)-O-[2-O,3-O-diacetyl-4-O-[3-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-2-O,4-O,6-O-triacetyl-β-D-galactopyranosyl]-β-D-xylopyranosyl]-L-serine benzyl ester
  • N-(Benzyloxycarbonyl)-O-[2-O,3-O-diacetyl-4-O-[2-O,4-O,6-O-triacetyl-3-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-β-D-galactopyranosyl]-β-D-xylopyranosyl]-L-serine benzyl ester
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