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Substance Name: Pyridoxine-5-isothiuronium bromide
RN: 23679-46-1
InChIKey: LQHQIUUOLFXMNI-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C9-H13-N3-O2-S.Br-H
Molecular Weight
- 308.199
Names and Synonyms
Results Name
- Pyridoxine-5-isothiuronium bromide
Synonyms
- 2-((5-Hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl)methyl)-2-thio-pseudourea hydrobromide
- Carbamimidothioic acid, (5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl)methyl ester HBr
- Pyridoxine-5-isothiuronium bromide
Systematic Name
- Pseudourea, 2-((5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridyl)methyl)-2-thio-, monohydrobromide
Registry Numbers
CAS Registry Number
- 23679-46-1
System Generated Number
- 0023679461
Molecular Formulas
Molecular Formula
- C9-H13-N3-O2-S.Br-H
Molecular Formula Fragments
- Br-H
- C9-H13-N3-O2-S
- COMPONENT
Structure Descriptors
InChI
1S/C9H13N3O2S.BrH/c1-5-8(14)7(3-13)6(2-12-5)4-15-9(10)11;/h2,13-14H,3-4H2,1H3,(H3,10,11);1HInChIKey
LQHQIUUOLFXMNI-UHFFFAOYSA-NSmiles
c1(c(O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 160mg/kg (160mg/kg) | Chemical and Pharmaceutical Bulletin. Vol. 22, Pg. 409, 1974. |