Chem
J-GLOBAL ID：200907021508197621
Nikkaji number：J2.398.908E
N-[8,8,8-Tris[1-[2-(α-D-mannopyranosyloxy)ethyl]-1H-1,2,3-triazole-4-ylmethoxymethyl]-3,6-dioxaoctane-1-yl]-4-penteneamide
N-[8,8,8-トリス[1-[2-(α-D-マンノピラノシルオキシ)エチル]-1H-1,2,3-トリアゾール-4-イルメトキシメチル]-3,6-ジオキサオクタン-1-イル]-4-ペンテンアミド
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
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
Molecular formula： C47H78N10O24
Molecular formula furigana： C47-H78-N10-O24
Molecular weight： 1167.187
InChI：
InChI=1S/C47H78N10O24/c1-2-3-4-34(61)48-5-9-71-13-14-72-24-47(25-73-21-28-15-55(52-49-28)6-10-76-44-41(68)38(65)35(62)31(18-58)79-44,26-74-22-29-16-56(53-50-29)7-11-77-45-42(69)39(66)36(63)32(19-59)80-45)27-75-23-30-17-57(54-51-30)8-12-78-46-43(70)40(67)37(64)33(20-60)81-46/h2,15-17,31-33,35-46,58-60,62-70H,1,3-14,18-27H2,(H,48,61)/t31-,32-,33-,35-,36-,37-,38+,39+,40+,41+,42+,43+,44+,45+,46+/m1/s1
InChI key：
VQVYAUQCWPUWMP-XADZFKCDSA-N
SMILES：
OC[C@H]1O[C@H](OCCn2cc(COCC(COCCOCCNC(=O)CCC=C)(COCc3cn(CCO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)nn3)COCc3cn(CCO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)nn3)nn2)[C@@H](O)[C@@H](O)[C@@H]1O
Systematic name (3)：
- N-[8,8,8-トリス[1-[2-(α-D-マンノピラノシルオキシ)エチル]-1H-1,2,3-トリアゾール-4-イルメトキシメチル]-3,6-ジオキサオクタン-1-イル]-4-ペンテンアミド
- N-{2-[2-(3-{[1-(2-{[(2S,3S,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}エチル)-1H-1,2,3-トリアゾール-4-イル]メトキシ}-2,2-ビス({[1-(2-{[(2S,3S,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}エチル)-1H-1,2,3-トリアゾール-4-イル]メトキシ}メチル)プロポキシ)エトキシ]エチル}ペンタ-4-エンアミド
- N-{2-[2-(3-{[1-(2-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)-1H-1,2,3-triazol-4-yl]methoxy}-2,2-bis({[1-(2-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)-1H-1,2,3-triazol-4-yl]methoxy}methyl)propoxy)ethoxy]ethyl}pent-4-enamide
- N-[8,8,8-Tris[1-[2-(α-D-mannopyranosyloxy)ethyl]-1H-1,2,3-triazole-4-ylmethoxymethyl]-3,6-dioxaoctane-1-yl]-4-penteneamide
Return to Previous Page
