Chem
J-GLOBAL ID:201507017645058150   Nikkaji number:J3.447.989E

2α-(4-O-(2-Hydroxyethyl)-2-amino-2-deoxy-α-D-glucopyranosyloxy)-3β,5β-diamino-6α-hydroxycyclohexane-1β-yl 3-O-(2,6-diamino-2,6-dideoxy-β-L-idopyranosyl)β-D-ribofuranoside

2α-(4-O-(2-ヒドロキシエチル)-2-アミノ-2-デオキシ-α-D-グルコピラノシルオキシ)-3β,5β-ジアミノ-6α-ヒドロキシシクロヘキサン-1β-イル3-O-(2,6-ジアミノ-2,6-ジデオキシ-β-L-イドピラノシル)β-D-リボフラノシド
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: C25H49N5O15
Molecular formula furigana: C25-H49-N5-O15
Molecular weight: 659.687
InChI: InChI=1S/C25H49N5O15/c26-4-9-15(35)16(36)12(29)23(40-9)44-21-11(6-33)42-25(18(21)38)45-22-14(34)7(27)3-8(28)19(22)43-24-13(30)17(37)20(39-2-1-31)10(5-32)41-24/h7-25,31-38H,1-6,26-30H2/t7-,8+,9+,10-,11-,12-,13-,14+,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25+/m1/s1
InChI key: DEEVTCKWQRBXRF-YXNGAHLDSA-N
SMILES: NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CO)[C@@H](OCCO)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Systematic name  (3):
  • 2α-(4-O-(2-ヒドロキシエチル)-2-アミノ-2-デオキシ-α-D-グルコピラノシルオキシ)-3β,5β-ジアミノ-6α-ヒドロキシシクロヘキサン-1β-イル3-O-(2,6-ジアミノ-2,6-ジデオキシ-β-L-イドピラノシル)β-D-リボフラノシド
  • (2S,3S,4R,5R,6R)-5-アミノ-2-(アミノメチル)-6-{[(2R,3S,4R,5S)-5-{[(1R,2R,3S,5R,6S)-3,5-ジアミノ-2-{[(2S,3R,4R,5S,6R)-3-アミノ-4-ヒドロキシ-5-(2-ヒドロキシエトキシ)-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-6-ヒドロキシシクロヘキシル]オキシ}-4-ヒドロキシ-2-(ヒドロキシメチル)オキソラン-3-イル]オキシ}オキサン-3,4-ジオール
  • (2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3S,4R,5S)-5-{[(1R,2R,3S,5R,6S)-3,5-diamino-2-{[(2S,3R,4R,5S,6R)-3-amino-4-hydroxy-5-(2-hydroxyethoxy)-6-(hydroxymethyl)oxan-2-yl]oxy}-6-hydroxycyclohexyl]oxy}-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}oxane-3,4-diol
Other name (1):
  • 2α-(4-O-(2-Hydroxyethyl)-2-amino-2-deoxy-α-D-glucopyranosyloxy)-3β,5β-diamino-6α-hydroxycyclohexane-1β-yl 3-O-(2,6-diamino-2,6-dideoxy-β-L-idopyranosyl)β-D-ribofuranoside
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