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Substance Name: Ryanodol, 18-hydroxy-, 3-(1H-pyrrole-2-carboxylate)
RN: 106821-56-1
InChIKey: KIFLYJJBQSTPLB-FDNDMGBNSA-N

Molecular Formula

  • C25-H35-N-O10

Molecular Weight

  • 509.548
 
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Names and Synonyms

Synonyms

  • 18-Hydroxyryanodine
  • 18-Hydroxyryanodol 3-(1H-pyrrole-2-carboxylate)
  • BRN 6025253

Systematic Name

  • Ryanodol, 18-hydroxy-, 3-(1H-pyrrole-2-carboxylate)

Registry Numbers

CAS Registry Number

  • 106821-56-1

System Generated Number

  • 0106821561

Structure Descriptors

InChI

1S/C25H35NO10/c1-12-7-8-20(30)18(3)11-21(31)19(4)22(32,13(2)10-27)17(35-16(29)14-6-5-9-26-14)23(18,33)25(19,34)24(20,36-21)15(12)28/h5-6,9,12-13,15,17,26-28,30-34H,7-8,10-11H2,1-4H3/t12-,13-,15+,17+,18+,19-,20-,21+,22+,23+,24?,25+/m0/s1

InChIKey

KIFLYJJBQSTPLB-FDNDMGBNSA-N

Smiles

[nH]1c(ccc1)C(=O)O[C@H]1[C@@]2(O)[C@@]3(C)C[C@@]4([C@@]([C@@]1([C@H](CO)C)O)([C@@]2([C@@]1([C@@H]([C@H](CC[C@@]31O)C)O)O4)O)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 900ug/kg (0.9mg/kg)   Journal of Medicinal Chemistry. Vol. 30, Pg. 710, 1987.