기본 정보
- 표준 SMILES
COC[C@@H]1C[C@H](C(=O)O)CN1C(=O)OC(C)(C)C- InChIKey
QYSZRXPVQLAOSQ-IUCAKERBSA-N- 분자식
- C12H21NO5
- 평균 분자량
- 259.3 g/mol
이름 및 식별자
- 우선 이름
- (3S,5S)-1-Boc-5-(methoxymethyl)pyrrolidine-3-carboxylic acid
- IUPAC
- (3S,5S)-5-(methoxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
이름 및 동의어
503026-91-3(3S,5S)-1-BOC-5-(METHOXYMETHYL)PYRROLIDINE-3-CARBOXYLIC ACID(3S,5S)-5-(methoxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acidQYSZRXPVQLAOSQ-IUCAKERBSA-N(3S,5S)-1-Boc-5-(methoxymethyl)pyrrolidine-3-carboxylicAcidSCHEMBL1841553(3S,5S)-5-(Methoxymethyl)-1,3-pyrrolidinedicarboxylic Acid 1-(1,1-Dimethylethyl) Estercis-5-Methoxymethyl-Boc-3-pyrrolidine carboxylic acid(3S,5S)-1-(tert-Butoxycarbonyl)-5-(methoxymethyl)pyrrolidine-3-carboxylic acid(3S,5S)-1-(tert-Butoxycarbonyl)-5-(methoxymethyl)pyrrolidine-3-carboxylicacid(3S,5S)-5-(Methoxymethyl)-1,3-pyrrolidinedicarboxylic Acid 1-(1,1-Dimethylethyl) Este
데이터베이스 식별자
- PubChem CID
- 60078797
물성
구조 계산 물성
- XLogP
- 0.7
- 극성 표면적
- 76.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 323
관련 반응
2건
화합물 노트
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