Chem
J-GLOBAL ID：200907077762827975   Nikkaji number：J1.507.177J

Hemeroside A

ヘメロシドA
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： C38H62O15
Molecular formula furigana： C38-H62-O15
Molecular weight： 758.899
InChI： InChI=1S/C38H62O15/c1-15-13-49-38(11-24(15)50-35-32(47)30(45)29(44)25(12-39)51-35)16(2)26-23(53-38)10-20-18-6-5-17-9-21(40)28(43)33(37(17,4)19(18)7-8-36(20,26)3)52-34-31(46)27(42)22(41)14-48-34/h15-35,39-47H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21+,22+,23+,24+,25-,26+,27+,28-,29-,30+,31-,32-,33-,34+,35-,36+,37+,38-/m1/s1
InChI key： TVGMHKTUAKOVIA-RNGZRXMDSA-N
SMILES： C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@@H]5C[C@H](O)[C@@H](O)[C@@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@]5(C)[C@H]4CC[C@]23C)O[C@@]21C[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](C)CO2
Systematic name  (3)：
  • (24S,25R)-1β-(α-L-アラビノピラノシルオキシ)-24-(β-D-グルコピラノシルオキシ)-5β-スピロスタン-2β,3α-ジオール
  • (2R,3S,4S,5R,6R)-2-(ヒドロキシメチル)-6-[(1'S,2R,2'S,4S,4'S,5R,7'S,8'R,9'S,12'S,13'S,14'S,15'R,16'S,18'R)-5,7',9',13'-テトラメチル-14'-{[(2S,3R,4S,5S)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}-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]-15',16'-ジオロキシ]オキサン-3,4,5-トリオール
  • (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(1'S,2R,2'S,4S,4'S,5R,7'S,8'R,9'S,12'S,13'S,14'S,15'R,16'S,18'R)-5,7',9',13'-tetramethyl-14'-{[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy}-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.02,9.04,8.013,18]icosane]-15',16'-dioloxy]oxane-3,4,5-triol
Other name (3)：
  • (24S,25R)-1β-(α-L-Arabinopyranosyloxy)-24-(β-D-glucopyranosyloxy)-5β-spirostane-2β,3α-diol
  • ヘメロシドA
  • Hemeroside A
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM