Chem
J-GLOBAL ID：200907060238457478   Nikkaji number：J2.075.517B

1-O-(5-Azidopentyl)-3-O,6-O-bis(2-O-α-D-mannopyranosyl-α-D-mannopyranosyl)-α-D-mannopyranose

1-O-(5-アジドペンチル)-3-O,6-O-ビス(2-O-α-D-マンノピラノシル-α-D-マンノピラノシル)-α-D-マンノピラノース
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： C35H61N[N-][N+]O26
Molecular formula furigana： C35-H61-N3-O26
Molecular weight： 939.868
InChI： InChI=1S/C35H61N3O26/c36-38-37-4-2-1-3-5-55-31-27(54)28(62-35-30(24(51)19(46)14(9-42)60-35)64-33-26(53)22(49)17(44)12(7-40)58-33)20(47)15(61-31)10-56-34-29(23(50)18(45)13(8-41)59-34)63-32-25(52)21(48)16(43)11(6-39)57-32/h11-35,39-54H,1-10H2/t11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+,31+,32-,33-,34+,35-/m1/s1
InChI key： YOJWAGXROVYFQO-FAOHPTSRSA-N
SMILES： OC[C@H]1O[C@H](O[C@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]2OC[C@H]2O[C@H](OCCCCCN=[N+]=[N-])[C@@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 1-O-(5-アジドペンチル)-3-O,6-O-ビス(2-O-α-D-マンノピラノシル-α-D-マンノピラノシル)-α-D-マンノピラノース
  • (2R,3S,4S,5S,6R)-2-{[(2S,3S,4S,5S,6R)-2-{[(2R,3R,4S,5S,6S)-6-[(5-アジドペンチル)オキシ]-4-{[(2R,3S,4S,5S,6R)-4,5-ジヒドロキシ-6-(ヒドロキシメチル)-3-{[(2R,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}オキサン-2-イル]オキシ}-3,5-ジヒドロキシオキサン-2-イル]メトキシ}-4,5-ジヒドロキシ-6-(ヒドロキシメチル)オキサン-3-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
  • (2R,3S,4S,5S,6R)-2-{[(2S,3S,4S,5S,6R)-2-{[(2R,3R,4S,5S,6S)-6-[(5-azidopentyl)oxy]-4-{[(2R,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,5-dihydroxyoxan-2-yl]methoxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1)：
  • 1-O-(5-Azidopentyl)-3-O,6-O-bis(2-O-α-D-mannopyranosyl-α-D-mannopyranosyl)-α-D-mannopyranose
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