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Substance Name: Reoselin A
RN: 53011-70-4
InChIKey: IRJOYYJBFNUUNS-HYEWAJBBSA-N

Molecular Formula

  • C36-H52-O15

Molecular Weight

  • 724.7918
 
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Names and Synonyms

Results Name

  • Reoselin A

Synonyms

  • BRN 1675994
  • Reoselin
  • Reoselin A
  • Rheozelin A

Systematic Name

  • 2H-1-Benzopyran-2-one, 7-((10-((2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-11-hydroxy-3,7,11-trimethyl-2,6-dodecadienyl)oxy)-, (S-(E,E))-

Registry Numbers

CAS Registry Number

  • 53011-70-4

System Generated Number

  • 0053011704

Structure Descriptors

InChI

1S/C36H52O15/c1-19(6-5-7-20(2)14-15-46-22-11-9-21-10-13-27(39)47-23(21)16-22)8-12-26(36(3,4)45)50-35-33(31(43)29(41)25(18-38)49-35)51-34-32(44)30(42)28(40)24(17-37)48-34/h6,9-11,13-14,16,24-26,28-35,37-38,40-45H,5,7-8,12,15,17-18H2,1-4H3/b19-6+,20-14+/t24-,25-,26+,28-,29-,30+,31+,32-,33-,34+,35+/m1/s1

InChIKey

IRJOYYJBFNUUNS-HYEWAJBBSA-N

Smiles

C/C(=C\CC/C(=C/COc1ccc2ccc(=O)oc2c1)/C)/CC[C@@H](C(C)(C)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD intravenous > 40mg/kg (40mg/kg) CARDIAC: ARRHYTHMIAS (INCLUDING CHANGES IN CONDUCTION)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

CARDIAC: OTHER CHANGES
Rastitel'nye Resursy. Plant Resources. Vol. 12, Pg. 259, 1976.