기본 정보
- CAS
7297-25-8- 표준 SMILES
O=[N+]([O-])OC[C@H](O[N+](=O)[O-])[C@@H](CO[N+](=O)[O-])O[N+](=O)[O-]- InChIKey
SNFOERUNNSHUGP-ZXZARUISSA-N- 분자식
- C4H6N4O12
- 평균 분자량
- 302.11 g/mol
- 단동위원소 질량
- 301.99822164
개요
Erythrityl tetranitrate is erythritol in which each of the hydroxy groups has been converted to the corresponding nitrate ester. It is a vasodilator with properties similar to nitroglycerin. It is usually used diluted with lactose or other suitable inert excipients, in order to minimise the risk of explosion; undiluted erythrityl tetranitrate can be exploded by percussion or excessive heat. It has a role as a vasodilator agent and an explosive. It is functionally related to an erythritol.
이름 및 식별자
- 우선 이름
- Erythrityl Tetranitrate
- IUPAC
- [(2R,3S)-1,3,4-trinitrooxybutan-2-yl] nitrate
- 영어명
- eritrityl tetranitrate
- 분자식
- C4H6N4O12
- 분자량
- 302.11
이름 및 동의어
ERYTHRITYL TETRANITRATEErythritol tetranitrateNitroerythrolEritrityl tetranitrateErythrol tetranitrateTetranitrol7297-25-8meso-Erythritol tetranitrateTetranitrate d'eritrityleTetranitrato de eritritiloEritrityli tetranitras1,2,3,4-Butanetetralyl tetranitrate
이름 더 보기
EritritylCardiloidCardivellCardiwellAids126358Aids-126358
CardilateEritritile tetranitratoC01DA1335X333P19DNSC-1065661,2,3,4-Butanetetrol, tetranitrate, (R*,S*)-DTXSID9022990CHEBI:60072
데이터베이스 식별자
- CAS
7297-25-8- PubChem CID
- 5284553
- DTXSID
DTXSID9022990- ChEMBL
CHEMBL2107583、CHEMBL453636- ChEBI
CHEBI:60072- UNII
- 35X333P19D
- EC Number
- 230-734-9
물성
구조 계산 물성
- XLogP
- 1.4
- 극성 표면적
- 220 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 12
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 326
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Listed in ZINC15
Solubility1.95e-01 g/L
Melting Point61 °C
Physical DescriptionSolid
물리화학적 성질
- 녹는점
- 61 ° · 61°
- 끓는 점
- 443.16 °C · 443.16°C (rough estimate)
- 밀도
- 1.757 · 1.757±0.06 g/cm3(Predicted)
- 굴절률
- 1.85 · 1.8500 (estimate)
화학적 성질
Crystals. Soluble in alcohol, ether, and glycerol; insoluble in water.
화학 및 산업
약리 정보
ATC Code
C - Cardiovascular system
QC - Cardiovascular system
PharmacodynamicsErythrityl Tetranitrate is a vasodilator with general properties similar to nitroglycerin.
Mechanism of Action
Similar to other nitrites and organic nitrates, erythrityl tetranitrate is converted to an active intermediate compound which activates the enzyme guanylate cyclase. This stimulates the synthesis of cyclic guanosine 3',5'-monophosphate (cGMP) which then activates a series of protein kinase-dependent phosphorylations in the smooth muscle cells, eventually resulting in the dephosphorylation of the myosin light chain of the smooth muscle fiber. The subsequent release of calcium ions results in the relaxation of the smooth muscle cells and vasodilation.
MeSH Pharmacological ClassificationDrugs used to cause dilation of the blood vessels.
Cellular LocationsMembrane
응용 분야
용도Vasodilator (coronary). Cardilate (Glaxo Wellcome{) [Name previously used: Erythrol Tetranitrate.].
공급사4 곳
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
SelectLab Chemicals GmbH+49-(0)2383-919350 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
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