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Substance Name: Picroside I
RN: 27409-30-9
InChIKey: XZGPUOQGERGURE-LUVHZPKESA-N

Note

  • Hepatoprotective agent.

Molecular Formula

  • C24-H28-O11

Molecular Weight

  • 492.4742
 
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Names and Synonyms

Name of Substance

  • Picroside I

Synonyms

  • 6'-Cinnamoylcatalpol
  • EINECS 248-445-1

Systematic Name

  • beta-D-Glucopyranoside, 1a,1b,2,5a,6,6a-hexahydro-6-hydroxy-1a-(hydroxymethyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl, 6-(3-phenyl-2-propenoate), (1aS-(1aalpha,1bbeta,2beta(E),5abeta,6beta,6aalpha))-

Registry Numbers

CAS Registry Number

  • 27409-30-9

Other Registry Number

  • 31200-45-0

System Generated Number

  • 0027409309

Structure Descriptors

InChI

1S/C24H28O11/c25-11-24-16-13(17(27)21(24)35-24)8-9-31-22(16)34-23-20(30)19(29)18(28)14(33-23)10-32-15(26)7-6-12-4-2-1-3-5-12/h1-9,13-14,16-23,25,27-30H,10-11H2/b7-6+/t13-,14-,16-,17+,18-,19+,20-,21+,22+,23+,24-/m1/s1

InChIKey

XZGPUOQGERGURE-LUVHZPKESA-N

Smiles

c1ccc(cc1)/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)O[C@H]3[C@H]4[C@@H](C=CO3)[C@@H]([C@H]5[C@@]4(O5)CO)O)O)O)O