기본 정보
- CAS
81131-70-6- 표준 SMILES
CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(=O)[O-])[C@H]21- InChIKey
TUZYXOIXSAXUGO-PZAWKZKUSA-M- 분자식
- C23H35O7-
- 평균 분자량
- 423.5 g/mol
개요
Pravastatin(1-) is a monocarboxylic acid anion resulting from the deprotonation of the carboxylic acid group of pravastatin. It is a conjugate base of a pravastatin.
이름 및 식별자
- 우선 이름
- Pravastatin(1-)
- IUPAC
- (3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-methylbutanoyl]oxy-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate
- 영어명
- Pravastatin sodium
- 분자식
- C23H36NaO7
- 분자량
- 447.52
이름 및 동의어
pravastatin(1-)CHEBI:63660RefChem:1096583Pravachol(3R,5R)-3,5-dihydroxy-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylbutanoyl]oxy}-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoate(3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-methylbutanoyl]oxy-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoateTUZYXOIXSAXUGO-PZAWKZKUSA-MBDBM50368146NSC779707STL553429AKOS037503356NSC-779707
이름 더 보기
PRAVASTATIN SODIUM SALTPravacs-514VastenELISORLipidalsq31000LiprevilPravacolPravasin
NCGC00247983-01AB01091488_02Q27132711(3R,5R)-3,5-dihydroxy-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(S)-2-methyl-butyryloxy]-1,2,6,7,8,8a-hexahydro-1-naphthyl]heptanoate
데이터베이스 식별자
물성
구조 계산 물성
- XLogP
- 2.3
- 극성 표면적
- 127 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 30
- 형식 전하
- -1
- 복잡도
- 650
물리화학적 성질
- 녹는점
- 171.2 · 171.2-173 °C
- 저장 조건
- 2 · 2-8°C
- 용해도
- 2 O: · H2O: 19 mg/mL
- 물리적 상태
- 가루
- 색상
- 하얀색
- 생물학적 소스
- synthetic (organic)
- 수용성
- 100 mg/mL · water: 100mg/mL
- Merck
- 14 · 14,7714
- BCS Class
- 1 · 1 (CLogP), 3 (LogP)
- 안정성
- 흡습성
- InChIKey
- AOGODJAJIRDKOP-ZSXJCKEYNA-N
- SMILES
- [NaH].OC(=O)C[C@@H](C[C@@H](CC[C@@H]1[C@]2([H])C(=C[C@H](C[C@@H]2OC(=O)[C@H](CC)C)O)C=C[C@@H]1C)O)O |&1:5,7,10,11,15,17,21,28,r|
화학적 성질
White Crystalline Powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- 2
- rtecs
- QJ7185000
- ridadr
- 3077
- HS 번호
- 29329990
- risk_code
- 11-34
- hazard_code
- F,C
- safety_code
- 16-26-36/37/39-45
- 포장분류
- III
- 위험 등급
- 9
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Pravastatin sodium is the salt of pravastatin, a ring-opened member of the statin family. Pravastatin is produced biosynthetically from compactin (mevastatin) by a number of microorganisms, notably Absidia, Cunninghamella, Syncephalastrum, Nocardia or Streptomyces. Typically, statins like compactin, lovastatin and simvastatin possess a β-hydroxy lactone ring which is a pro-drug for the readily ring-opened dihydroxyacid generally regarded as the active HMG-CoAreductase inhibitor. Importantly, the free carboxylic acid enables pravastatin to be freely water soluble within biological pH ranges.
일반 설명A water-soluble, competitive 3-hydroxy-3-methylglutaryl coenzyme A (HMG-CoA) reductase inhibitor that potently blocks in vivo cholesterol synthesis (Ki = ~1 nM). Offers cardioprotection. Also acts as an immunomodulator and an inhibitor of ras p21 isoprenylation.
상·하류 제품 정보
상류 원료
공급사101 곳
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