기본 정보
- 표준 SMILES
C=C1CS(=O)C2C(NC(=O)COc3ccccc3)C(=O)N2C1C(=O)OCc1ccc([N+](=O)[O-])cc1- InChIKey
HBKWKOGDTHDLLR-UHFFFAOYSA-N- 분자식
- C23H21N3O8S
- 평균 분자량
- 499.5 g/mol
- 단동위원소 질량
- 499.10493581
이름 및 식별자
- 우선 이름
- Einecs 262-423-9
- IUPAC
- (4-nitrophenyl)methyl 3-methylidene-5,8-dioxo-7-[(2-phenoxyacetyl)amino]-5lambda4-thia-1-azabicyclo[4.2.0]octane-2-carboxylate
- 영어명
- 4-Nitrobenzyl [2R-(2alpha,5beta,6alpha,7beta)]-3-methylene-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate 5-oxide
- 분자식
- C23H21N3O8S
- 분자량
- 499.49
이름 및 동의어
60771-27-9(4-Nitrophenyl)methyl 3-methylidene-5,8-dioxo-7-[(2-phenoxyacetyl)amino]-5lambda4-thia-1-azabicyclo[4.2.0]octane-2-carboxylate4-Nitrobenzyl[2r-(2alpha,5beta,6alpha,7beta)]-3-methylene-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate5-oxideEINECS 262-423-9(4-Nitrophenyl)methyl (2R,6R,7R)-3-methylidene-5,8-dioxo-7-[(2-phenoxyacetyl)amino]-5lambda4-thia-1-azabicyclo[4.2.0]octane-2-carboxylate4-nitrobenzyl 3-methylidene-8-oxo-7-[(phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate 5-oxideOprea1_078903DTXSID90976245STK384444AKOS000715170AKOS0220616384-Nitrobenzyl (2R-(2alpha,5beta,6alpha,7beta))-3-methylene-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)octane-2-carboxylate5-oxide
이름 더 보기
4-nitrobenzyl [2R-(2α,5β,6α,7β)]-3-methylene-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate 5-oxide(2R,6β)-3-Methylene-2β-[[(4-nitrophenyl)methoxy]carbonyl]-8-oxo-7α-[(phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane5-oxide4-nitrobenzyl (2r-(2alpha,5beta,6alpha,7beta))-3-methylene-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)octane-2-carboxylate 5-oxide4-nitrobenzyl [2R-(2alpha,5beta,6alpha,7beta)]-3-methylene-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate 5-oxide5-Thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid, 3-methylene-8-oxo-7-[(phenoxyacetyl)amino]-, (4-nitrophenyl)methyl ester, 5-oxide, (2R,5S,6R,7R)-
NS00121833ST50028325AE-641/40197999(4-nitrophenyl)methyl 3-methylene-5,8-dioxo-7-(2-phenoxyacetylamino)-5-thia-1- azabicyclo[4.2.0]octane-2-carboxylate4-nitrobenzyl 3-methylene-8-oxo-7-[(phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate 5-oxideN-(3-Methylidene-2-{[(4-nitrophenyl)methoxy]carbonyl}-5,8-dioxo-5lambda~4~-thia-1-azabicyclo[4.2.0]octan-7-yl)(phenoxy)ethanimidic acidN-(3-Methylidene-2-{[(4-nitrophenyl)methoxy]carbonyl}-5,8-dioxo-5lambda~4~-thia-1-azabicyclo[4.2.0]octan-7-yl)-2-phenoxyethanimidic acid
데이터베이스 식별자
- CAS
60771-27-9- PubChem CID
- 108511
- EC Number
- 262-423-9
물성
구조 계산 물성
- XLogP
- 1.2
- 극성 표면적
- 167 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 35
- 형식 전하
- 0
- 복잡도
- 892
화학 및 산업
공급사2 곳
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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