기본 정보
- CAS
1357252-81-3- 표준 SMILES
C[C@]12CC[C@H]3[C@@H]([C@H]4C[C@H]4[C@]4(O)CC(=O)CC[C@]34C)[C@@H]1[C@@H]1C[C@@H]1[C@@]2(O)CCCO- InChIKey
BJGLEUDFODCURD-HOPUHREQSA-N- 분자식
- C24H36O4
- 평균 분자량
- 388.5 g/mol
- 단동위원소 질량
- 388.26135963
이름 및 식별자
- 우선 이름
- 5-Beta-Hydroxy-Drospirenone-17-Propanol
- IUPAC
- (1R,2R,4R,5R,10R,11S,14S,15S,16S,18S,19S)-5,15-dihydroxy-15-(3-hydroxypropyl)-10,14-dimethylhexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadecan-7-one
- 영어명
- 17α-[3-Hydroxypropyl]-6β,7β:15β,16β-diMethylen-5β-androstan-5,17β-ol-3-one
- 분자식
- C24H36O4
- 분자량
- 388.54
이름 및 동의어
1357252-81-35-Beta-Hydroxy-Drospirenone-17-Propanol(1R,2R,4R,5R,10R,11S,14S,15S,16S,18S,19S)-5,15-dihydroxy-15-(3-hydroxypropyl)-10,14-dimethylhexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadecan-7-one5?-Hydroxy Drospirenone Ring-opened Alcohol Impurity17alpha-[3-hydroxypropyl]-6beta,7betaDTXSID60857759(1aR,1bR,5aR,5bS,7aS,8S,8aS,9aS,9bS,9cR,9dR)-1b,8-Dihydroxy-8-(3-hydroxypropyl)-5a,7a-dimethyloctadecahydro-3H-cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthren-3-one5β-Hydroxy Drospirenone Ring-opened Alcohol IMpurity5β-Hydroxy Drospirenone Ring-opened Alcohol Impurity, CAS 1357252-81-317α-[3-Hydroxypropyl]-6β,7β:15β,16β-diMethylen-5β-androstan-5,17β-ol-3-one17alpha-(3-hydroxypropyl)-6beta,7beta,15beta,16beta-dimethylen-5beta-androstan-5,17beta-ol-3-one(5R,6R,7R,8R,9S,10R,13S,14S,15S,16S,17S)-Octadecahydro-5,17-dihydroxy-17-(3-hydroxypropyl)-10,13-diMethyl-3H-dicyclopropa[6,7:15,16]cyclopenta[a]phenanthren-3-one
이름 더 보기
3H-Dicyclopropa[6,7:15,16]cyclopenta[a]phenanthren-3-one, octadecahydro-5,17-dihydroxy-17-(3-hydroxypropyl)-10,13-dimethyl-, (5R,6R,7R,8R,9S,10R,13S,14S,15S,16S,17S)-
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 77.8 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 736
물리화학적 성질
- 끓는 점
- 544.9 · 544.9±50.0 °C(Predicted)
- 밀도
- 1.266 · 1.266±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 13.95 · 13.95±0.70(Predicted)
화학 및 산업
응용 분야
용도5-Hydroxy Drospirenone Ring-opened Alcohol Impurity is an impurity of Drospirenone (D689500).
상·하류 제품 정보
상류 원료
공급사14 곳
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
上海陶素生化科技有限公司
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