기본 정보
- 표준 SMILES
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)[C@@H](OC)[C@@H]1CCCN1C(=O)OC(C)(C)C- InChIKey
RDNYSJATGQDZQN-BTHPGYMESA-N- 분자식
- C24H36N2O6
- 평균 분자량
- 448.6 g/mol
이름 및 식별자
- 우선 이름
- tert-Butyl (S)-2-((1R,2R)-1-methoxy-3-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-2-methyl-3-oxopropyl)pyrrolidine-1-carboxylate
- IUPAC
- tert-butyl (2S)-2-[(1R,2R)-1-methoxy-3-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-2-methyl-3-oxopropyl]pyrrolidine-1-carboxylate
이름 및 동의어
MMAF intermediate 1161485-82-1tert-Butyl (S)-2-((1R,2R)-1-methoxy-3-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-2-methyl-3-oxopropyl)pyrrolidine-1-carboxylateN-Boc-Dap-Phe-OMeorb2663884SCHEMBL14956963RDNYSJATGQDZQN-BTHPGYMESA-NRDNYSJATGQDZQN-DXBWTPJFSA-NEX-A12425HHY-79253CS-0011377G76476
이름 더 보기
T89657(S)-TERT-BUTYL 2-((1R,2R)-1-METHOXY-3-(((S)-1-METHOXY-1-OXO-3-PHENYLPROPAN-2-YL)AMINO)-2-METHYL-3-O(S)-tert-butyl 2-((1R,2R)-1-methoxy-3-(((S)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-2-methyl-3-oxopropyl)pyrrolidine-1-carboxylate1-Pyrrolidinecarboxylic acid, 2-[(1R,2R)-1-methoxy-3-[[(1S)-2-methoxy-2-oxo-1-(phenylmethyl)ethyl]amino]-2-methyl-3-oxopropyl]-, 1,1-dimethylethyl ester, (2S)-methyl N-{(2R,3R)-3-[(2S)-1-(tert-butoxycarbonyl)pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl}-L-phenylalaninatet-butyl(s)-2-((1r,2r)-1-methoxy-3-(((s)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-2-methyl-3-oxopropyl)pyrrolidine-1-carboxylatetert-butyl (2S)-2-[(1R,2R)-1-methoxy-3-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-2-methyl-3-oxopropyl]pyrrolidine-1-carboxylatetert-butyl (S)-2-((1R,2R)-1-methoxy-3-(((R)-1-methoxy-1-oxo-3-phenylpropan-2-yl)amino)-2-methyl-3-oxopropyl)pyrrolidine-1-carboxylate
데이터베이스 식별자
- PubChem CID
- 86685729
물성
구조 계산 물성
- XLogP
- 3.3
- 극성 표면적
- 94.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 641
관련 반응
2건
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