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Substance Name: Heterocodeine
RN: 639-47-4
UNII: SBO5K94K8L
InChIKey: FNAHUZTWOVOCTL-XSSYPUMDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H21-N-O3

Molecular Weight

  • 299.368
 
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Names and Synonyms

Results Name

  • Heterocodeine

Name of Substance

  • Heterocodeine

Synonyms

  • BRN 4268039
  • EINECS 211-356-3
  • Heterocodeine
  • Morphine alcoholic methyl ether
  • Morphine, 6-methyl ester
  • Morphine, O(sup 6)-methyl-
  • Morphine, O(sup6)-methyl-
  • NSC 134601
  • UNII-SBO5K94K8L

Systematic Names

  • (5alpha,6alpha)-7,8-Didehydro-4,5-epoxy-6-methoxy-17-methylmorphinan-3-ol
  • Morphinan-3-ol, 7,8-didehydro-4,5-alpha-epoxy-6-alpha-methoxy-17-methyl-
  • Morphinan-3-ol, 7,8-didehydro-4,5-epoxy-6-methoxy-17-methyl-, (5alpha,6alpha)- (9CI)
  • Morphine, O6-methyl- (8CI)

Registry Numbers

CAS Registry Number

  • 639-47-4

FDA UNII

  • SBO5K94K8L

System Generated Number

  • 0000639474

Structure Descriptors

InChI

1S/C18H21NO3/c1-19-8-7-18-11-4-6-14(21-2)17(18)22-16-13(20)5-3-10(15(16)18)9-12(11)19/h3-6,11-12,14,17,20H,7-9H2,1-2H3/t11-,12+,14-,17-,18-/m0/s1

InChIKey

FNAHUZTWOVOCTL-XSSYPUMDSA-N

Smiles

c1(c2c3[C@@]45[C@@H](O2)[C@@H](OC)C=C[C@H]4[C@@H](Cc3cc1)[N@](CC5)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 72mg/kg (72mg/kg)   "Public Health Reports, Supplement." Vol. 138, Pg. 8, 1938.