기본 정보
- CAS
70776-86-2- 표준 SMILES
CC(=O)CCN(CCC(=O)c1ccccc1)C[C@]1(C)CCC[C@]2(C)c3ccc(C(C)C)cc3CC[C@@H]12- InChIKey
FTRRZOWJRMUNGJ-XFCANUNOSA-N- 분자식
- C33H45NO2
- 평균 분자량
- 487.7 g/mol
- 단동위원소 질량
- 487.34502968
개요
See other relationships...
이름 및 식별자
- 우선 이름
- (1R-(1alpha,4abeta,10aalpha))-4-(((7-Isopropyl-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethylphenanthren-1-yl)methyl)(3-oxo-3-phenylpropyl)amino)butan-2-one
- IUPAC
- 4-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methyl-(3-oxo-3-phenylpropyl)amino]butan-2-one
- 현지명
- (1R-(1알파,4A 베타,10A 알파))-4-(((7-아이소프로필-1,2,3,4,4A,9,10, 10A-옥타...
- 영어명
- [1R-(1alpha,4abeta,10aalpha)]-4-[[[7-isopropyl-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethylphenanthren-1-yl]methyl](3-oxo-3-phenylpropyl)amino]butan-2-one
- 분자식
- C33H45NO2
- 분자량
- 487.72
이름 및 동의어
70776-86-2EINECS 274-880-1(1R-(1alpha,4abeta,10aalpha))-4-(((7-Isopropyl-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethylphenanthren-1-yl)methyl)(3-oxo-3-phenylpropyl)amino)butan-2-oneDTXSID20892181FTRRZOWJRMUNGJ-XFCANUNOSA-N4-{[Abieta-8(14),9(11),12-trien-18-yl](3-oxo-3-phenylpropyl)amino}butan-2-one2-Butanone, 4-(((1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl)methyl)(3-oxo-3-phenylpropyl)amino)-, (1theta-(1alpha,4abeta,10aalpha))-2-Butanone, 4-[[[1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl]methyl](3-oxo-3-phenylpropyl)amino]-, [1R-(1alpha,4alpha beta,10a alpha)]-(1R-(1알파,4A베타,10A알파))-4-(((7-아이소프로필-1,2,3,4,4A,9,10,10A-옥타...complex substituted ketoamine4-[[[(1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-Octahydro-1,4a-dimethyl-7-isopropylphenanthrene-1-yl]methyl](3-oxo-3-phenylpropyl)amino]-2-butanone4-[[[[(1R)-1,2,3,4,4a,9,10,10aα-Octahydro-1β,4aβ-dimethyl-7-(1-methylethyl)phenanthren]-1-yl]methyl](3-oxo-3-phenylpropyl)amino]-2-butanone
물성
구조 계산 물성
- XLogP
- 7.4
- 극성 표면적
- 37.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 755
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationHazard Traits - Bioaccumulation; Environmental Persistence
안전 데이터
- 기존화학 물질
- KE-26594
화학 및 산업
공급사1 곳
Portail Substances Chimiques[email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…