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Substance Name: Retronecine
RN: 480-85-3
UNII: 2P5723M6II
InChIKey: HJSJELVDQOXCHO-HTQZYQBOSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C8-H13-N-O2

Molecular Weight

  • 155.196
 
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Names and Synonyms

Name of Substance

  • (+)-Retronecine
  • Retronecine

Synonyms

  • (+)-Retronecine
  • 1H-Pyrrolizine-7-methanol, 2,3,5,7a-beta-tetrahydro-1-alpha-hydroxy-
  • CCRIS 5776
  • HSDB 3567
  • Retronecin
  • Senecifolinene
  • UNII-2P5723M6II

Systematic Names

  • 1H-Pyrrolizine-7-methanol, 2,3,5,7a-tetrahydro-1-hydroxy-, (1R-trans)- (9CI)
  • Retronecine

Registry Numbers

CAS Registry Number

  • 480-85-3

FDA UNII

  • 2P5723M6II

System Generated Number

  • 0000480853

Structure Descriptors

InChI

1S/C8H13NO2/c10-5-6-1-3-9-4-2-7(11)8(6)9/h1,7-8,10-11H,2-5H2/t7-,8-/m1/s1

InChIKey

HJSJELVDQOXCHO-HTQZYQBOSA-N

Smiles

C=1([C@H]2[N@@](CC1)CC[C@H]2O)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 634mg/kg (634mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of Pharmacology and Experimental Therapeutics. Vol. 75, Pg. 78, 1942.
rat LD50 intravenous 1311mg/kg (1311mg/kg) BLOOD: "LYMPHOMA, INCLUDING HODGKIN'S DISEASE"

LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA

LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), DIFFUSE"
Research Today. Vol. 5, Pg. 53, 1949.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 119.5 deg C   EXP
log P (octanol-water) -0.560 (none)   EST
Atmospheric OH Rate Constant 1.25E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.