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Substance Name: Cynapanoside A
RN: 109972-32-9
InChIKey: RZJAWQPCJQGGPS-HZXVBAKSSA-N

Note

  • Glycoside from Chinese crude drug xu-chang-qing, Cynanchum paniculatum.

Molecular Formula

  • C28-H40-O9

Molecular Weight

  • 520.615
 
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Names and Synonyms

Name of Substance

  • Cynapanoside A

Systematic Name

  • 6H-2,3,5-Trioxapentaleno(1',6':5,6,7)cyclonona(1,2-a)naphthalen-6-one, 10-((2,6-dideoxy-3-O-methyl-beta-D-arabino-hexopyranosyl)oxy)-2a,4,4a,6a,7,9,10,11,12,12a,12b,13,14,14b-tetradecahydro-7-hydroxy-2a,12a-dimethyl-, (2aR-(2aR*,4aS*,6aR*,7S*,10S*,12aR*,12bS*,14bR*))-

Registry Numbers

CAS Registry Number

  • 109972-32-9

System Generated Number

  • 0109972329

Structure Descriptors

InChI

1S/C28H40O9/c1-14-25(30)20(32-4)11-22(35-14)36-17-7-8-27(2)16(9-17)10-19(29)23-18(27)6-5-15-12-33-28(3)24(15)21(13-34-28)37-26(23)31/h10,12,14,17-25,29-30H,5-9,11,13H2,1-4H3/t14-,17+,18+,19+,20-,21-,22+,23+,24-,25-,27+,28+/m1/s1

InChIKey

RZJAWQPCJQGGPS-HZXVBAKSSA-N

Smiles

CO[C@@H]1C[C@H](O[C@H]2CC[C@]3(C)[C@H]4CCC5=CO[C@@]6(C)OC[C@@H](OC(=O)[C@@H]4[C@@H](O)C=C3C2)[C@@H]56)O[C@H](C)[C@H]1O