기본 정보
- CAS
245523-67-5- 표준 SMILES
CC(C)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C- InChIKey
ZNCHPOYZMVVJCK-LIZWOPGQSA-N- 분자식
- C27H46O3
- 평균 분자량
- 418.7 g/mol
개요
(24S)-7alpha,24-dihydroxycholesterol is a 7alpha,24-dihydroxycholesterol in which has S configuration at position 24. It has a role as a human metabolite.
이름 및 식별자
- 우선 이름
- (24S)-cholest-5-ene-3beta,7alpha,24-triol
- IUPAC
- (3S,7S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
- 영어명
- 7α,24(S)-Dihydroxycholesterol
- 분자식
- C27H46O3
- 분자량
- 418.65
이름 및 동의어
(24S)-Cholest-5-ene-3beta,7alpha,24-triol5-Cholesten-3beta,7alpha,24(S)-triol(3S,7S,8S,9S,10R,13R,14S,17R)-17-((2R,5S)-5-hydroxy-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta(a)phenanthrene-3,7-diol(3S,7S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diolRefChem:10497397alpha,24(S)-Dihydroxycholesterol245523-67-5(24S)-7alpha,24-dihydroxycholesterol7alpha,24S-dihydroxycholesterolcholest-5-en-3beta,7alpha,24S-triol7?,24(S)-Dihydroxycholesterolorb2695680
이름 더 보기
7α,24(S)-Dihydroxycholesterol7α,24(S)-dihydroxy cholesterolCholest-5-ene-3,7,24-triol, (3β,7α,24S)-
SCHEMBL25293174CHEBI:376407|A,24(S)-dihydroxycholesterol(24S)-7alpha-dihydroxycholesterolLMST04030168CS-0134002(24S)-cholest-5-ene-3-beta,7-alpha,24-triolT200871
물성
구조 계산 물성
- XLogP
- 5.9
- 극성 표면적
- 60.7 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 656
실험 및 물리화학적 성질
LipidsLipids -> Sterol Lipids [ST] -> Bile acids and derivatives [ST04] -> C27 bile acids, alcohols, and derivatives [ST0403]
물리화학적 성질
- 끓는 점
- 548.5 · 548.5±35.0 °C(Predicted)
- 밀도
- 1.08 · 1.08±0.1 g/cm3(Predicted)
- 저장 조건
- -20 °C · -20°C
- 산도 계수 (pKa)
- 14.1 · 14.10±0.70(Predicted)
- 물리적 상태
- powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
약리 정보
Cellular LocationsMembrane
응용 분야
용도7α,24(S)-Dihydroxycholesterol is a sterol found to be,one of several, the most abundant cholesterol metabolite and an intermediate of bile acid biosynthetic pathways.
일반 설명7α,24(S)-dihydroxycholesterol (24(S)-dihydroxycholesterol) is synthetically synthesized via from E-α, β-enone from the starting compounds Arsonium ylide and J-tert-butyldimethylsilyloxy-bisnor-5-cholenaldehyde. This undergoes further changes to form 7α,24(S)-dihydroxycholesterol.
공급사4 곳
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Creative Enzymes1-516-855-7709 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
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