기본 정보
- CAS
85733-91-1- 표준 SMILES
CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(C)=O- InChIKey
ZXCIEWBDUAPBJF-UHFFFAOYSA-N- 분자식
- C28H58NO7P
- 평균 분자량
- 551.7 g/mol
- 단동위원소 질량
- 551.39509019
개요
reported to have same biological activity as natural PAF-acether; RN given refers to parent cpd without isomeric designation
이름 및 식별자
- 우선 이름
- 3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-, inner salt, 4-oxide
- IUPAC
- (2-acetyloxy-3-octadecoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
- 영어명
- 1-0-octadecyl 2-0-acetyl sn-glycero-3-phosphorylcholine
- 분자식
- C28H58NO7P
- 분자량
- 551.736381
이름 및 동의어
85733-91-11-0-octadecyl 2-0-acetyl sn-glycero-3-phosphorylcholineDTXSID501110671octadecyl PAFoctadecyl-AGPC3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-, inner salt, 4-oxideoctadecyl-PAF-acetherRefChem:910672DTXCID4014669281-O-Octadecyl-2-O-acetyl-sn-glyceryl-3-phosphorylcholineBlood platelet activating factor-aetherPlatelet Activating Factor C-18
이름 더 보기
(2-acetyloxy-3-octadecoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate1-Stearyl-2-O-acetyl-3-glyceryl phosphorylcholine(+-)-1-O-Octadecyl-2-acetylglyceryl-3-phosphorylcholine3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-, hydroxide, inner salt, 4-oxideCHEMBL12852SCHEMBL34464893PC O-18:0_2:0DB-055871
데이터베이스 식별자
- CAS
85733-91-1- PubChem CID
- 2501
- DTXSID
DTXSID501110671
물성
구조 계산 물성
- XLogP
- 7.6
- 극성 표면적
- 94.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 28
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 575
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS.
Drugs used to cause dilation of the blood vessels.
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