기본 정보
- 표준 SMILES
Cc1ncc(CO)c(CN)c1O.Cl.Cl- InChIKey
HNWCOANXZNKMLR-UHFFFAOYSA-N- 분자식
- C8H14Cl2N2O2
- 평균 분자량
- 241.11 g/mol
- 단동위원소 질량
- 240.04323305
개요
Pyridoxamine dihydrochloride is a hydrochloride obtained by combining pyridoxamine with two molar equivalents of hydrochloric acid. Used for treatment of diabetic nephropathy. It has a role as an iron chelator, a mouse metabolite, a Saccharomyces cerevisiae metabolite, a nephroprotective agent, a plant metabolite, an Escherichia coli metabolite and a human metabolite. It is a vitamin B6 and a hydrochloride. It contains a pyridoxamine(2+).
이름 및 식별자
- 우선 이름
- Pyridoxamine, dihydrochloride
- IUPAC
- 4-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol;dihydrochloride
이름 및 동의어
PYRIDOXAMINE DIHYDROCHLORIDE524-36-7Pyridoxylamine dihydrochloride4-(Aminomethyl)-5-hydroxy-6-methyl-3-pyridinemethanol dihydrochlorideYQ8NCR7V0ODTXSID60450882-Methyl-3-hydroxy-4-aminomethyl-5-hydroxymethylpyridene dihydrochlorideDTXCID4025088CHEBI:131532PYRIDOXAMINE, MONOHYDROCHLORIDENSC-21278Pyridoxamine, dihydrochloride
이름 더 보기
RefChem:870905208-357-64-(aminomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol dihydrochloridePyridoxamine 2HClPyridorinPyridoxamine dichlorohydratePyridoxylamine (dihydrochloride)pyridoxaminedihydrochloride
데이터베이스 식별자
- CAS
524-36-7- PubChem CID
- 10664
- DTXSID
DTXSID6045088- ChEMBL
CHEMBL2361504- ChEBI
CHEBI:131532- UNII
- YQ8NCR7V0O
- EC Number
- 208-357-6
물성
구조 계산 물성
- 극성 표면적
- 79.4 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 143
실험 및 물리화학적 성질
Chemical ClassesBiological Agents -> Vitamins and Derivatives
Vapor Pressure0.00000144 [mmHg]
Physical DescriptionSolid; [Merck Index] White to off-white solid; [Acros Organics MSDS]
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (97.7%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazards SummaryCauses convulsions in oral and subcutaneous lethal-dose studies of mice and rats; [RTECS] An irritant; [Acros Organics MSDS] See Pyridoxine hydrochloride.
Hazard Classes and CategoriesSkin Irrit. 2 (97.7%)
화학 및 산업
용도 및 제조
UsesThe 4-aminomethyl form of VITAMIN B 6. During transamination of amino acids, PYRIDOXAL PHOSPHATE is transiently converted into pyridoxamine phosphate. [ChemIDplus]
관련 반응
1건
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