Chem
J-GLOBAL ID:201507007046725827   Nikkaji number:J3.447.992E

2α-(4-O-(α-D-Mannopyranosyl)-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-(α-D-マンノピラノシル)-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: C29H55N5O19
Molecular formula furigana: C29-H55-N5-O19
Molecular weight: 777.775
InChI: InChI=1S/C29H55N5O19/c30-2-8-15(39)17(41)12(33)26(46-8)51-24-11(5-37)49-29(21(24)45)53-25-14(38)6(31)1-7(32)22(25)50-27-13(34)18(42)23(10(4-36)48-27)52-28-20(44)19(43)16(40)9(3-35)47-28/h6-29,35-45H,1-5,30-34H2/t6-,7+,8+,9-,10-,11-,12-,13-,14+,15-,16-,17-,18-,19+,20+,21-,22-,23-,24-,25-,26-,27-,28-,29+/m1/s1
InChI key: ZHFQMOSSRFXPTN-JDDJXUFZSA-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](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Systematic name  (3):
  • 2α-(4-O-(α-D-マンノピラノシル)-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
  • (2R,3S,4S,5S,6R)-2-{[(2R,3S,4R,5R,6S)-5-アミノ-6-{[(1R,2R,3S,4R,6S)-4,6-ジアミノ-2-{[(2S,3R,4S,5R)-4-{[(2R,3R,4R,5S,6S)-3-アミノ-6-(アミノメチル)-4,5-ジヒドロキシオキサン-2-イル]オキシ}-3-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]オキシ}-3-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-{[(2R,3S,4R,5R,6S)-5-amino-6-{[(1R,2R,3S,4R,6S)-4,6-diamino-2-{[(2S,3R,4S,5R)-4-{[(2R,3R,4R,5S,6S)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-3-hydroxycyclohexyl]oxy}-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
  • 2α-(4-O-(α-D-Mannopyranosyl)-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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