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Substance Name: Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride
RN: 24999-30-2
InChIKey: DOYURYFHQKITAN-MJSHISICSA-M

Molecular Formula

  • C24-H36-N2-O6.Cl

Molecular Weight

  • 485.017
 
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Names and Synonyms

Synonym

  • N-(7-Hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)heliotrinium chloride

Systematic Name

  • Heliotrinium, N-(7-hydroxy-6,7-dihydro-5H-pyrrolizin-1-ylmethyl)-, chloride

Registry Numbers

CAS Registry Number

  • 24999-30-2

System Generated Number

  • 0024999302

Molecular Formulas

Molecular Formula

  • C24-H36-N2-O6.Cl

Molecular Formula Fragments

  • C24-H36-N2-O6
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C24H37N2O6.ClH/c1-15(2)24(30,16(3)31-4)23(29)32-14-18-7-11-26(12-8-20(28)22(18)26)13-17-5-9-25-10-6-19(27)21(17)25;/h5,7,9,15-16,19-20,22,27-28,30H,6,8,10-14H2,1-4H3;1H/q+1;/p-1/t16?,19?,20-,22?,24?,26?;/m0./s1

InChIKey

DOYURYFHQKITAN-MJSHISICSA-M

Smiles

C([N@@+]12[C@@H](C(COC([C@@]([C@@H](OC)C)(C(C)C)O)=O)=CC1)[C@@H](O)CC2)c1c2n(CC[C@@H]2O)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo intraperitoneal 194mg/kg (194mg/kg)   Chemico-Biological Interactions. Vol. 12, Pg. 299, 1976.