기본 정보
- CAS
51762-04-0- 표준 SMILES
CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CCCC(N)C(=O)O)[C@H]2SC1.[Na+]- InChIKey
HZWLVUKHUSRPCG-BJIHTTGYSA-M- 분자식
- C16H20N3NaO8S
- 평균 분자량
- 437.4 g/mol
- 단동위원소 질량
- 437.08688006
이름 및 식별자
- 우선 이름
- Cephalosporin C sodium
- IUPAC
- sodium (6R,7R)-3-(acetyloxymethyl)-7-[(5-amino-5-carboxypentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
- 영어명
- sodium hydrogen [6R-[6alpha,7beta(R*)]]-3-(acetoxymethyl)-7-[(5-amino-5-carboxylato-1-oxopentyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
- 분자식
- C16H22N3NaO8S
- 분자량
- 439.41
이름 및 동의어
CEPHALOSPORIN C SODIUMSodium cephalosporin CCephalosporin C sodium salt51762-04-0sodium;(6R,7R)-3-(acetyloxymethyl)-7-[(5-amino-5-carboxypentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylateEINECS 257-390-2ZG30U24Q08UNII-ZG30U24Q08SCHEMBL11011969DTXSID201996875-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-7-(((5R)-5-amino-5-carboxy-1-oxopentyl)amino)-8-oxo-, monosodium salt, (6R,7R)-5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-7-((5-amino-5-carboxy-1-oxopentyl)amino)-8-oxo-, monosodium salt, (6R-(6alpha,7beta(R*)))-
이름 더 보기
Cefuroxime Sodium Impurity 6(7R)-3-(Acetyloxymethyl)-7-[[(R)-5-amino-5-carboxy-1-oxopentyl]amino]cepham-3-ene-4-carboxylic acid 4-sodium salt(6R)-3-acetoxymethyl-7t-((R)-5-amino-5-carboxy-pentanoylamino)-8-oxo-(6rH)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylicacid,monosodiumsalsodium hydrogen [6R-[6alpha,7beta(R*)]]-3-(acetoxymethyl)-7-[(5-amino-5-carboxylato-1-oxopentyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-7-[[(5R)-5-amino-5-carboxy-1-oxopentyl]amino]-8-oxo-, sodium salt (1:1), (6R,7R)-sodium hydrogen [6R-[6alpha,7beta(R*)]]-3-(acetoxymethyl)-7-[(5-amino-5-carboxylato-1-oxopentyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Sodium (6R,7R)-3-[(acetyloxy)methyl]-7-(5-amino-5-carboxypentanamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
데이터베이스 식별자
- CAS
51762-04-0- PubChem CID
- 23680388
- DTXSID
DTXSID20199687- EC Number
- 257-390-2
물성
구조 계산 물성
- 극성 표면적
- 204 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 744
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P233, P260, P261, P271, P272, P280, P284, P302+P352, P304+P340, P321, P333+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Sens. 1 (100%)
안전 데이터
- 신호 어
- Danger
- 유해·위험 문구
- 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H317
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