Chem
J-GLOBAL ID:201507015699498063
Nikkaji number:J3.447.988G
2α-(4-O-Propyl-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-プロピル-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
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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:
C26 H51 N5 O14
Molecular formula furigana:
C26-H51-N5-O14
Molecular weight:
657.715
InChI:
InChI=1S/C26H51N5O14/c1-2-3-39-21-11(6-32)41-25(14(31)18(21)37)43-20-9(29)4-8(28)15(34)23(20)45-26-19(38)22(12(7-33)42-26)44-24-13(30)17(36)16(35)10(5-27)40-24/h8-26,32-38H,2-7,27-31H2,1H3/t8-,9+,10+,11-,12-,13-,14-,15+,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26+/m1/s1
InChI key:
OXAFJDMIESCVIC-CJTVRSDBSA-N
SMILES:
CCCO[C@@H]1[C@@H](CO)O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O[C@H]3O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@H]2O)[C@H](N)[C@H]1O
Systematic name (3):
2α-(4-O-プロピル-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-6-(ヒドロキシメチル)-5-プロポキシオキサン-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-6-(hydroxymethyl)-5-propoxyoxan-2-yl]oxy}-6-hydroxycyclohexyl]oxy}-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}oxane-3,4-diol
Other name (1):
2α-(4-O-Propyl-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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