Chem
J-GLOBAL ID：200907030030597091   Nikkaji number：J1.252.086G

4-(2-Oxo-2-methoxyethyl)benzyl 2-O,3-O,4-O-tribenzyl-6-O-[2-O,3-O,4-O-tribenzyl-6-O-(4-azido-3-chlorobenzyl)-α-D-glucopyranosyl]-α-D-glucopyranoside

4-(2-オキソ-2-メトキシエチル)ベンジル2-O,3-O,4-O-トリベンジル-6-O-[2-O,3-O,4-O-トリベンジル-6-O-(4-アジド-3-クロロベンジル)-α-D-グルコピラノシル]-α-D-グルコピラノシド
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： C71H72ClN[N-][N+]O13
Molecular formula furigana： C71-H72-CL-N3-O13
Molecular weight： 1210.820
InChI： InChI=1S/C71H72ClN3O13/c1-77-63(76)39-50-32-34-57(35-33-50)47-85-70-68(83-45-55-28-16-6-17-29-55)67(82-44-54-26-14-5-15-27-54)65(80-42-52-22-10-3-11-23-52)62(88-70)49-86-71-69(84-46-56-30-18-7-19-31-56)66(81-43-53-24-12-4-13-25-53)64(79-41-51-20-8-2-9-21-51)61(87-71)48-78-40-58-36-37-60(74-75-73)59(72)38-58/h2-38,61-62,64-71H,39-49H2,1H3/t61-,62-,64-,65-,66+,67+,68-,69-,70+,71+/m1/s1
InChI key： RZUKCWZUTXNPNF-QBNHGLQRSA-N
SMILES： COC(=O)Cc1ccc(CO[C@H]2O[C@H](CO[C@H]3O[C@H](COCc4ccc(N=[N+]=[N-])c(Cl)c4)[C@@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)cc1
Systematic name  (3)：
  • 4-(2-オキソ-2-メトキシエチル)ベンジル2-O,3-O,4-O-トリベンジル-6-O-[2-O,3-O,4-O-トリベンジル-6-O-(4-アジド-3-クロロベンジル)-α-D-グルコピラノシル]-α-D-グルコピラノシド
  • メチル 2-[4-({[(2S,3R,4S,5R,6R)-6-({[(2S,3R,4S,5R,6R)-6-{[(4-アジド-3-クロロフェニル)メトキシ]メチル}-3,4,5-トリス(ベンジルオキシ)オキサン-2-イル]オキシ}メチル)-3,4,5-トリス(ベンジルオキシ)オキサン-2-イル]オキシ}メチル)フェニル]アセタート
  • methyl 2-[4-({[(2S,3R,4S,5R,6R)-6-({[(2S,3R,4S,5R,6R)-6-{[(4-azido-3-chlorophenyl)methoxy]methyl}-3,4,5-tris(benzyloxy)oxan-2-yl]oxy}methyl)-3,4,5-tris(benzyloxy)oxan-2-yl]oxy}methyl)phenyl]acetate
Other name (1)：
  • 4-(2-Oxo-2-methoxyethyl)benzyl 2-O,3-O,4-O-tribenzyl-6-O-[2-O,3-O,4-O-tribenzyl-6-O-(4-azido-3-chlorobenzyl)-α-D-glucopyranosyl]-α-D-glucopyranoside
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