Chem
J-GLOBAL ID：200907085854495459   Nikkaji number：J1.052.677I

1-O-(1-Imino-2,2,2-trichloroethyl)-4-O-(2-O,3-O,4-O,6-O-tetraacetyl-α-D-galactopyranosyl)-α-D-galactopyranose 2,3,6-tribenzoate

1-O-(1-イミノ-2,2,2-トリクロロエチル)-4-O-(2-O,3-O,4-O,6-O-テトラアセチル-α-D-ガラクトピラノシル)-α-D-ガラクトピラノース2,3,6-トリベンゾアート
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： C43H42Cl3NO18
Molecular formula furigana： C43-H42-CL3-N-O18
Molecular weight： 967.150
InChI： InChI=1S/C43H42Cl3NO18/c1-22(48)55-20-29-31(57-23(2)49)33(58-24(3)50)35(59-25(4)51)40(60-29)64-32-30(21-56-37(52)26-14-8-5-9-15-26)61-41(65-42(47)43(44,45)46)36(63-39(54)28-18-12-7-13-19-28)34(32)62-38(53)27-16-10-6-11-17-27/h5-19,29-36,40-41,47H,20-21H2,1-4H3/t29-,30-,31+,32+,33+,34+,35-,36-,40-,41-/m1/s1
InChI key： PQNZMYPKSYJFEU-ZFBPYKNJSA-N
SMILES： CC(=O)OC[C@H]1O[C@H](O[C@H]2[C@@H](COC(=O)c3ccccc3)O[C@H](OC(=N)C(Cl)(Cl)Cl)[C@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]1OC(=O)C
Systematic name  (3)：
  • 1-O-(1-イミノ-2,2,2-トリクロロエチル)-4-O-(2-O,3-O,4-O,6-O-テトラアセチル-α-D-ガラクトピラノシル)-α-D-ガラクトピラノース2,3,6-トリベンゾアート
  • [(2R,3S,4S,5R,6R)-4,5-ビス(ベンゾイルオキシ)-6-[(2,2,2-トリクロロエタンイミドイル)オキシ]-3-{[(2R,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]メチル ベンゾアート
  • [(2R,3S,4S,5R,6R)-4,5-bis(benzoyloxy)-6-[(2,2,2-trichloroethanimidoyl)oxy]-3-{[(2R,3R,4S,5S,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl]methyl benzoate
Other name (1)：
  • 1-O-(1-Imino-2,2,2-trichloroethyl)-4-O-(2-O,3-O,4-O,6-O-tetraacetyl-α-D-galactopyranosyl)-α-D-galactopyranose 2,3,6-tribenzoate
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM