기본 정보
- CAS
38778-30-2- 표준 SMILES
CC(C)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@]4(O)C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3[C@H](O)C[C@]12C- InChIKey
LRJUYAVTHIEHAI-LHBNDURVSA-N- 분자식
- C27H44O8
- 평균 분자량
- 496.6 g/mol
- 단동위원소 질량
- 496.30361836
개요
Muristerone A is a 6-oxo steroid that is 5beta-cholest-7-en-6-one substituted by hydroxy groups at positions 2, 3, 5, 11, 14, 20 and 22 respectively (the 2beta,3beta,5beta,11alpha,14alpha,20R,22R-stereoisomer). It is a phytoecdysteroid produced by the kaladana plant Ipomoea calonyction. It has a role as a protein synthesis inhibitor and a plant metabolite. It is an 11alpha-hydroxy steroid, a phytoecdysteroid, a 3beta-sterol, a 20-hydroxy steroid, a 2beta-hydroxy steroid, a 14alpha-hydroxy steroid, a 22-hydroxy steroid, a 6-oxo steroid and a 5beta-hydroxy steroid. It derives from a hydride of a 5beta-cholestane.
이름 및 식별자
- 우선 이름
- Muristerone A
- IUPAC
- (2S,3R,5S,9R,10R,11R,13R,14S,17S)-17-[(2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl]-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one
- 영어명
- MURISTERONE A
- 분자식
- C27H44O8
- 분자량
- 496.63
이름 및 동의어
muristerone a38778-30-2(2S,3R,5S,9R,10R,11R,13R,14S,17S)-17-[(2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl]-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-6-one(2S,3R,5S,9R,10R,11R,13R,14S,17S)-17-((2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl)-2,3,5,11,14-pentahydroxy-10,13-dimethyl-1,2,3,4,9,11,12,15,16,17-decahydrocyclopenta(a)phenanthren-6-oneRefChem:160129MuristeroneDTXSID409595832beta,3beta,5beta,11alpha,14alpha,20R,22R-Heptahydro xycholest-7-en-6-oneorb1704998CHEMBL2087139SCHEMBL19419608CHEBI:232104
이름 더 보기
MURAEcdysonic sterolMURISTERONE A(P)MURISTERONE A USP/EP/BPMURISTERONE A, IPOMOEA SPPMuristerone A, EcR agonist5B, 7-CHOLESTENE-2B,3B,5A,11A,14,20,22-HEPTOL-6-ONE2B,3B,5A,11A,14,20,22-HEPTAHYDROXY-5B-7-CHOLESTEN-6-ONE
BDBM50488539HB3985LMST01010542MFCD00056450AKOS024457813FM52413(22R)-2beta,3beta,5,11alpha,14,20,22-Heptahydroxy-5beta-cholest-7-en-6-oneMS-32731
물성
구조 계산 물성
- XLogP
- -0.1
- 극성 표면적
- 159 Ų
- 수소 결합 공여자 수
- 7
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 904
실험 및 물리화학적 성질
LipidsLipids -> Sterol Lipids [ST] -> Sterols [ST01] -> Cholesterol and derivatives [ST0101]
물리화학적 성질
- 끓는 점
- 707.2 · 707.2±60.0 °C(Predicted)
- 밀도
- 1.33 · 1.33±0.1 g/cm3(Predicted)
- 저장 조건
- 20 °C · −20°C
- 용해도
- DMSO에 용해됨
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 11.78 · 11.78±0.70(Predicted)
- 색상
- 하얀색
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- wgk
- 3
화학 및 산업
응용 분야
개요Muristerone A is a natural analog of 20-hydroxyecdysone . It is an agonist of the ecdysteroid receptor (Kd = 1 nM), a nuclear receptor that heterodimerizes with a retinoid X receptor ortholog and regulates arthropod development. Muristerone A is used as an agonist in ecdysone-inducible gene expression systems in mammalian cells. However, it inhibits apoptosis in the human colon carcinoma cell line RKO by inducing the upregulation of Bcl-xL, suggesting limitations in its use in certain types of studies.
용도Muristerone A, an ecdysteroid, is widely used for the induction of ecdysteroid-dependent transcription in mammalian cells.
공급사19 곳
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
宁波君龙新材料有限公司0574 88552218 18969899212 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
上海陶术生物科技股份有限公司
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