기본 정보
- 표준 SMILES
CC(C)(C)OC(=O)CCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)OC(C)(C)C- InChIKey
ODBJVRJGYMWZLP-MHZLTWQESA-N- 분자식
- C33H61NO7
- 평균 분자량
- 583.8 g/mol
- 단동위원소 질량
- 583.44480328
이름 및 식별자
- 우선 이름
- (S)-5-(tert-Butoxy)-4-(20-(tert-butoxy)-20-oxoicosanamido)-5-oxopentanoic acid
- IUPAC
- (4S)-5-[(2-methylpropan-2-yl)oxy]-4-[[20-[(2-methylpropan-2-yl)oxy]-20-oxoicosanoyl]amino]-5-oxopentanoic acid
이름 및 동의어
1119061-70-9tBuO-C20-Glu-OtBuC20-OTBU-GLU-OTBU(S)-5-(tert-Butoxy)-4-(20-(tert-butoxy)-20-oxoicosanamido)-5-oxopentanoic acidSemaglutide impurity 851-(1,1-Dimethylethyl) hydrogen N-[20-(1,1-dimethylethoxy)-1,20-dioxoeicosyl]-L-glutamatetBuO-C20-Glu(OH)-OtBuSCHEMBL2166317MFCD35460565(S)-2-(19-tert-Butoxycarbonylnonadecanoylamino)pentanedioic acid 1-tert-butyl esterAS-97206FD184008
이름 더 보기
SY308170L-glutamic acid, N-[20-(1,1-dimethylethoxy)-1,20-dioxoeicosyl]-, 1-(1,1-dimethylethyl) esterG87427(S)-4-(19-Boc-nonadecanamido)-4-Boc-butanoic Acid(4S)-5-(tert-butoxy)-4-[20-(tert-butoxy)-20-oxoicosanamido]-5-oxopentanoic acid1-(1,1-Dimethylethyl) hydrogen?N-[20-(1,1-dimethylethoxy)-1,20-dioxoeicosyl]-L-glutamate(S)-5-(t-Butoxy)-4-(20-(t-butoxy)-20-oxoicosanamido)-5-oxopentanoic acid (C20-OtBu-L-Glu-OtBu)L-Glutamic acid, N-[20-(1,1-dimethylethoxy)-1,20-dioxoeicosyl]-, 1-(1,1-dimethylethyl) este
데이터베이스 식별자
- PubChem CID
- 87347291
물성
구조 계산 물성
- XLogP
- 9.4
- 극성 표면적
- 119 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 28
- 무거운 원자 수
- 41
- 형식 전하
- 0
- 복잡도
- 737
관련 반응
2건
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