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Substance Name: (1-Hydroxy-1-methyl-3-phenylpropyl)-6,14-endo-ethenotetrahydrooripavine
RN: 14521-98-3
InChIKey: ALOSAFNTVICCGI-XELDOGJXSA-N

Molecular Formula

  • C30-H35-N-O4

Molecular Weight

  • 473.609
 
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Names and Synonyms

Name of Substance

  • (1-Hydroxy-1-methyl-3-phenylpropyl)-6,14-endo-ethenotetrahydrooripavine

Systematic Name

  • 6,14-Ethenomorphinan-7-methanol, alpha,17-dimethyl-4,5-epoxy-3-hydroxy-6-methoxy-alpha-(2-phenylethyl)-, (5-alpha,7-alpha(R))-

Registry Numbers

CAS Registry Number

  • 14521-98-3

System Generated Number

  • 0014521983

Structure Descriptors

InChI

1S/C30H35NO4/c1-27(33,12-11-19-7-5-4-6-8-19)22-18-28-13-14-30(22,34-3)26-29(28)15-16-31(2)23(28)17-20-9-10-21(32)25(35-26)24(20)29/h4-10,13-14,22-23,26,32-33H,11-12,15-18H2,1-3H3/t22-,23-,26-,27-,28-,29+,30-/m1/s1

InChIKey

ALOSAFNTVICCGI-XELDOGJXSA-N

Smiles

c1(ccccc1)CC[C@@]([C@@H]1[C@@]2(OC)C=C[C@@]3([C@@H]4[N@](CC[C@@]53c3c(ccc(O)c3O[C@@H]25)C4)C)C1)(C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg)   Agents and Actions, A Swiss Journal of Pharmacology. Vol. 6, Pg. 755, 1976.