Chem
J-GLOBAL ID：200907051188173334   Nikkaji number：J38.808D

Prosapogenin D′2

プロサポゲニンD′2
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： C38H60O12
Molecular formula furigana： C38-H60-O12
Molecular weight： 708.886
InChI： InChI=1S/C38H60O12/c1-18-7-12-38(46-16-18)19(2)28-26(50-38)14-24-22-6-5-20-13-21(8-10-36(20,3)23(22)9-11-37(24,28)4)47-35-32(44)33(30(42)27(15-39)48-35)49-34-31(43)29(41)25(40)17-45-34/h5,18-19,21-35,39-44H,6-17H2,1-4H3/t18-,19+,21+,22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32-,33+,34+,35-,36+,37+,38-/m1/s1
InChI key： ZAMIINHQZFJOPA-RBVXQHKOSA-N
SMILES： C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]23C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)O[C@@]21CC[C@@H](C)CO2
Systematic name  (4)：
  • [(25R)-スピロスタ-5-エン-3β-イル]3-O-β-D-キシロピラノシル-β-D-グルコピラノシド
  • [(25R)-スピロスタン-5-エン-3β-イル]3-O-β-D-キシロピラノシル-β-D-グルコピラノシド
  • (2S,3R,4S,5R)-2-{[(2R,3R,4S,5R,6R)-3,5-ジヒドロキシ-2-(ヒドロキシメチル)-6-[(1'S,2R,2'S,4'S,5R,7'S,8'R,9'S,12'S,13'R,16'S)-5,7',9',13'-テトラメチル-5'-オキサスピロ[オキサン-2,6'-ペンタシクロ[10.8.0.02,9.04,8.013,18]イコサン]-18'-エネオキシ]オキサン-4-イル]オキシ}オキサン-3,4,5-トリオール
  • (2S,3R,4S,5R)-2-{[(2R,3R,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(1'S,2R,2'S,4'S,5R,7'S,8'R,9'S,12'S,13'R,16'S)-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.02,9.04,8.013,18]icosan]-18'-eneoxy]oxan-4-yl]oxy}oxane-3,4,5-triol
Other name (4)：
  • プロサポゲニンD′2
  • Prosapogenin D′2
  • [(25R)-Spirost-5-en-3β-yl]3-O-β-D-xylopyranosyl-β-D-glucopyranoside
  • [(25R)-Spirostane-5-ene-3β-yl]3-O-β-D-xylopyranosyl-β-D-glucopyranoside
CAS registry number： 65604-99-1
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM