Chem
J-GLOBAL ID：200907024591250627   Nikkaji number：J727.876D

Lycoperoside D

リコペロシドD
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： C39H65NO12
Molecular formula furigana： C39-H65-N-O12
Molecular weight： 739.944
InChI： InChI=1S/C39H65NO12/c1-18-7-12-39(40-15-18)19(2)28-25(52-39)14-24-22-6-5-20-13-21(8-10-37(20,3)23(22)9-11-38(24,28)4)48-35-33(47)31(45)34(27(17-42)50-35)51-36-32(46)30(44)29(43)26(16-41)49-36/h18-36,40-47H,5-17H2,1-4H3/t18-,19-,20-,21-,22+,23-,24-,25-,26+,27+,28-,29+,30-,31+,32+,33+,34-,35+,36-,37-,38-,39+/m0/s1
InChI key： KNFKROLCBJOHLX-QKWCTKJQSA-N
SMILES： C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@H]5C[C@H](CC[C@]5(C)[C@H]4CC[C@]23C)O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)O[C@@]21CC[C@H](C)CN2
Systematic name  (3)：
  • (22R,25S)-3β-[(4-O-β-D-グルコピラノシル-β-D-ガラクトピラノシル)オキシ]-5α-スピロソラン
  • (2S,3R,4S,5S,6R)-2-{[(2R,3R,4R,5R,6R)-4,5-ジヒドロキシ-2-(ヒドロキシメチル)-6-[(1R,2S,4S,5'S,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-テトラメチル-5-オキサスピロ[ペンタシクロ[10.8.0.02,9.04,8.013,18]イコサン-6,2'-ピペリジン]オキシ]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
  • (2S,3R,4S,5S,6R)-2-{[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'S,6R,7S,8R,9S,12S,13S,16S,18S)-5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-piperidine]oxy]oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (3)：
  • リコペロシドD
  • Lycoperoside D
  • (22R,25S)-3β-[(4-O-β-D-Glucopyranosyl-β-D-galactopyranosyl)oxy]-5α-spirosolane
Thsaurus map：
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