Chem
J-GLOBAL ID:200907031939095953
Nikkaji number:J1.060.813I
(3R,5R)-3,5-Dihydroxypiperidine-4-yl 4-O-[4-O-(4-O-α-D-glucopyranosyl-α-D-glucopyranosyl)-α-D-glucopyranosyl]-α-D-glucopyranoside
(3R,5R)-3,5-ジヒドロキシピペリジン-4-イル4-O-[4-O-(4-O-α-D-グルコピラノシル-α-D-グルコピラノシル)-α-D-グルコピラノシル]-α-D-グルコピラノシド
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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:
C29 H51 NO23
Molecular formula furigana:
C29-H51-N-O23
Molecular weight:
781.711
InChI:
InChI=1S/C29H51NO23/c31-3-9-13(37)14(38)18(42)26(46-9)51-23-11(5-33)48-28(20(44)16(23)40)53-25-12(6-34)49-29(21(45)17(25)41)52-24-10(4-32)47-27(19(43)15(24)39)50-22-7(35)1-30-2-8(22)36/h7-45H,1-6H2/t7?,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:
OUEORLLDXRFRKS-YJGOEUGYSA-N
SMILES:
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](OC5C(O)CNCC5O)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name (3):
(3R,5R)-3,5-ジヒドロキシピペリジン-4-イル4-O-[4-O-(4-O-α-D-グルコピラノシル-α-D-グルコピラノシル)-α-D-グルコピラノシル]-α-D-グルコピラノシド
(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-[(3,5-ジヒドロキシピペリジン-4-イル)オキシ]-4,5-ジヒドロキシ-2-(ヒドロキシメチル)オキサン-3-イル]オキシ}-4,5-ジヒドロキシ-2-(ヒドロキシメチル)オキサン-3-イル]オキシ}-4,5-ジヒドロキシ-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,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-6-[(3,5-dihydroxypiperidin-4-yl)oxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
(3R,5R)-3,5-Dihydroxypiperidine-4-yl 4-O-[4-O-(4-O-α-D-glucopyranosyl-α-D-glucopyranosyl)-α-D-glucopyranosyl]-α-D-glucopyranoside
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