Chem
J-GLOBAL ID：200907056459675359   Nikkaji number：J2.112.557A

1-O-Methyl-2-O-(6-O-acetyl-3-O,4-O-dibenzyl-2-azido-2-deoxy-α-D-glucopyranosyl)-4-O-[4-O-(2-O,3-O,4-O,6-O-tetrabenzyl-β-D-galactopyranosyl)-2-O,3-O,6-O-tribenzyl-α-D-glucopyranosyl]-6-O,7-O-diacetyl-α-L-glycero-D-manno-heptopyranose

1-O-メチル-2-O-(6-O-アセチル-3-O,4-O-ジベンジル-2-アジド-2-デオキシ-α-D-グルコピラノシル)-4-O-[4-O-(2-O,3-O,4-O,6-O-テトラベンジル-β-D-ガラクトピラノシル)-2-O,3-O,6-O-トリベンジル-α-D-グルコピラノシル]-6-O,7-O-ジアセチル-α-L-glycero-D-manno-ヘプトピラノース
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： C95H105N[N-][N+]O24
Molecular formula furigana： C95-H105-N3-O24
Molecular weight： 1672.882
InChI： InChI=1S/C95H105N3O24/c1-63(99)106-61-77-81(108-52-68-36-18-7-19-37-68)85(110-54-70-40-22-9-23-41-70)79(97-98-96)92(116-77)122-87-80(102)86(83(119-93(87)103-4)78(115-65(3)101)62-107-64(2)100)121-95-91(114-58-74-48-30-13-31-49-74)89(112-56-72-44-26-11-27-45-72)84(76(118-95)60-105-51-67-34-16-6-17-35-67)120-94-90(113-57-73-46-28-12-29-47-73)88(111-55-71-42-24-10-25-43-71)82(109-53-69-38-20-8-21-39-69)75(117-94)59-104-50-66-32-14-5-15-33-66/h5-49,75-95,102H,50-62H2,1-4H3/t75-,76-,77-,78+,79-,80+,81-,82+,83-,84-,85-,86+,87+,88+,89+,90-,91-,92-,93-,94+,95-/m1/s1
InChI key： ANNKGYGOYSSAIN-FHELEEOUSA-N
SMILES： CO[C@@H]1O[C@H]([C@H](COC(=O)C)OC(=O)C)[C@@H](O[C@H]2O[C@H](COCc3ccccc3)[C@@H](O[C@@H]3O[C@H](COCc4ccccc4)[C@H](OCc4ccccc4)[C@H](OCc4ccccc4)[C@H]3OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)[C@H](O)[C@@H]1O[C@H]1O[C@H](COC(=O)C)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1N=[N+]=[N-]
Systematic name  (3)：
  • 1-O-メチル-2-O-(6-O-アセチル-3-O,4-O-ジベンジル-2-アジド-2-デオキシ-α-D-グルコピラノシル)-4-O-[4-O-(2-O,3-O,4-O,6-O-テトラベンジル-β-D-ガラクトピラノシル)-2-O,3-O,6-O-トリベンジル-α-D-グルコピラノシル]-6-O,7-O-ジアセチル-α-L-glycero-D-manno-ヘプトピラノース
  • (1S)-2-(アセチルオキシ)-1-[(2R,3S,4S,5S,6R)-5-{[(2R,3R,4R,5S,6R)-6-[(アセチルオキシ)メチル]-3-アジド-4,5-ビス(ベンジルオキシ)オキサン-2-イル]オキシ}-3-{[(2R,3R,4S,5R,6R)-3,4-ビス(ベンジルオキシ)-6-[(ベンジルオキシ)メチル]-5-{[(2S,3R,4S,5S,6R)-3,4,5-トリス(ベンジルオキシ)-6-[(ベンジルオキシ)メチル]オキサン-2-イル]オキシ}オキサン-2-イル]オキシ}-4-ヒドロキシ-6-メトキシオキサン-2-イル]エチル アセタート
  • (1S)-2-(acetyloxy)-1-[(2R,3S,4S,5S,6R)-5-{[(2R,3R,4R,5S,6R)-6-[(acetyloxy)methyl]-3-azido-4,5-bis(benzyloxy)oxan-2-yl]oxy}-3-{[(2R,3R,4S,5R,6R)-3,4-bis(benzyloxy)-6-[(benzyloxy)methyl]-5-{[(2S,3R,4S,5S,6R)-3,4,5-tris(benzyloxy)-6-[(benzyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-6-methoxyoxan-2-yl]ethyl acetate
Other name (1)：
  • 1-O-Methyl-2-O-(6-O-acetyl-3-O,4-O-dibenzyl-2-azido-2-deoxy-α-D-glucopyranosyl)-4-O-[4-O-(2-O,3-O,4-O,6-O-tetrabenzyl-β-D-galactopyranosyl)-2-O,3-O,6-O-tribenzyl-α-D-glucopyranosyl]-6-O,7-O-diacetyl-α-L-glycero-D-manno-heptopyranose
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM