Chem
J-GLOBAL ID:200907001272037155
Nikkaji number:J1.486.441E
1-Fluoro-2-azido-3-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-4-O,6-O-(di-tert-butylsilanediyl)-1,2-dideoxy-β-D-galactopyranose
1-フルオロ-2-アジド-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)-4-O,6-O-(ジ-tert-ブチルシランジイル)-1,2-ジデオキシ-β-D-ガラクトピラノース
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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:
C28 H44 FN[N-][N+]O13 Si
Molecular formula furigana:
C28-H44-F-N3-O13-SI
Molecular weight:
677.751
InChI:
InChI=1S/C28H44FN3O13Si/c1-13(33)37-11-17-20(39-14(2)34)23(40-15(3)35)24(41-16(4)36)26(43-17)44-22-19(31-32-30)25(29)42-18-12-38-46(27(5,6)7,28(8,9)10)45-21(18)22/h17-26H,11-12H2,1-10H3/t17-,18-,19-,20+,21+,22-,23+,24-,25-,26+/m1/s1
InChI key:
RBWMTCBNBGLTCM-JEDAOZCXSA-N
SMILES:
CC(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H]3O[Si](OC[C@H]3O[C@@H](F)[C@@H]2N=[N+]=[N-])(C(C)(C)C)C(C)(C)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@H]1OC(=O)C
Systematic name (3):
1-フルオロ-2-アジド-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)-4-O,6-O-(ジ-tert-ブチルシランジイル)-1,2-ジデオキシ-β-D-ガラクトピラノース
[(2R,3S,4S,5R,6R)-6-{[(4aR,6S,7R,8R,8aR)-7-アジド-2,2-ジ-tert-ブチル-6-フルオロ-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3,2]ジオキサシリン-8-イル]オキシ}-3,4,5-トリス(アセチルオキシ)オキサン-2-イル]メチル アセタート
[(2R,3S,4S,5R,6R)-6-{[(4aR,6S,7R,8R,8aR)-7-azido-2,2-di-tert-butyl-6-fluoro-hexahydro-2H-pyrano[3,2-d][1,3,2]dioxasilin-8-yl]oxy}-3,4,5-tris(acetyloxy)oxan-2-yl]methyl acetate
Other name (1):
1-Fluoro-2-azido-3-O-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-galactopyranosyl)-4-O,6-O-(di-tert-butylsilanediyl)-1,2-dideoxy-β-D-galactopyranose
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