기본 정보
- 표준 SMILES
C[C@@H](C(=O)N[C@H](C(=O)O)C1CCCCC1)N(C)C(=O)OC(C)(C)C- InChIKey
DZNWFBAGRUJPNF-AAEUAGOBSA-N- 분자식
- C17H30N2O5
- 평균 분자량
- 342.4 g/mol
이름 및 식별자
- 우선 이름
- (2S)-[[N-(tert-Butoxycarbonyl)-N-methyl-L-alanyl]amino](cyclohexyl)ethanoic acid
- IUPAC
- (2S)-2-cyclohexyl-2-[[(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoyl]amino]acetic acid
이름 및 동의어
894789-27-6(2S)-[[N-(tert-Butoxycarbonyl)-N-methyl-L-alanyl]amino](cyclohexyl)ethanoic acid(S)-2-((S)-2-((tert-butoxycarbonyl)(methyl)amino)propanamido)-2-cyclohexylacetic acid(2S)-2-cyclohexyl-2-[[(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoyl]amino]acetic acid(2S)-{[N-(tert-butoxycarbonyl)-N-methyl-L-alanyl]amino}(cyclohexyl)ethanoic acid(S)-[(S)-2-(tert-Butoxycarbonyl-methyl-amino)-propionylamino]-cyclohexyl-acetic acid(S)-[(S)-2-(tert-butoxycarbonyl-methyl-amino)-propionylamino}-cyclohexyl-acetic acid(2S)-2-[(2S)-2-{[(tert-butoxy)carbonyl](methyl)amino}propanamido]-2-cyclohexylacetic acidMFCD28411459SCHEMBL1054148DZNWFBAGRUJPNF-AAEUAGOBSA-NGlycine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-L-alanyl-2-cyclohexyl-, (2S)- (9CI)
이름 더 보기
CS-M3236AKOS037650477CS-14865C12827(2S)-[[N-(tert-Butoxycarbonyl)-N-methyl-L-alanyl]amino](cyclohexyl)ethanoicacid(S)-2-((S)-2-(tert-butoxycarbonyl(methyl)amino)propanamido)-2-cyclohexylacetic acid(2S)-2-[[(2S)-2-[tert-butoxycarbonyl(methyl)amino]propanoyl]amino]-2-cyclohexyl-acetic acid
데이터베이스 식별자
- PubChem CID
- 17748007
- Nikkaji
- J2.626.259C
물성
구조 계산 물성
- XLogP
- 2.9
- 극성 표면적
- 95.9 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 466
공급사
불러오는 중…
공개 문의
불러오는 중…
관련 반응
3건
화합물 노트
불러오는 중…