기본 정보
- 표준 SMILES
CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)CCCC(=O)O)[C@H]2SC1- InChIKey
IXUSDMGLUJZNFO-BXUZGUMPSA-N- 분자식
- C15H18N2O8S
- 평균 분자량
- 386.4 g/mol
- 단동위원소 질량
- 386.07838654
개요
(7R)-7-(4-carboxybutanamido)cephalosporanic acid is a cephalosporin. It is functionally related to a cephalosporanic acid. It is a conjugate acid of a (7R)-7-(4-carboxylatobutanamido)cephalosporanate.
이름 및 식별자
- 우선 이름
- Glutaryl-7-aminocephalosporanic acid
- IUPAC
- (6R,7R)-3-(acetyloxymethyl)-7-(4-carboxybutanoylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- 현지명
- 글루타릴-7-아미노세팔로스포란산
- 영어명
- glutaryl-7-aminocephalosporanic acid
- 분자식
- C15H18N2O8S
- 분자량
- 386.38
이름 및 동의어
Glutaryl-7-acaGlutaryl-7-aminocephalosporanic acidGl-7-Aca27920-90-7DTXSID40182197(6R,7R)-3-(acetyloxymethyl)-7-(4-carboxybutanoylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid(6R,7R)-3-(acetyloxymethyl)-7-(4-carboxybutanoylamino)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acidRefChem:922314DTXCID501046887-Glutarylaminocephalosporanate7BETA-(4CARBOXYBUTANAMIDO) CEPHALOSPORANIC ACID(7R)-7-(4-Carboxybutanamido)cephalosporanate
이름 더 보기
글루타릴-7-아미노세팔로스포란산5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-7-[(4-carboxy-1-oxobutyl)amino]-8-oxo-, (6R,7R)-
(7R)-7-(4-carboxybutanamido)cephalosporanic acid(6R,7R)-3-[(acetyloxy)methyl]-7-(4-carboxybutanamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid(6R,7R)-3-(Acetoxymethyl)-7-(4-carboxybutanamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid(6R,7R)-3-[(acetyloxy)methyl]-7-[(4-carboxybutanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acidglutaryl-7ACAGlutaryl 7ACAglutaryl 7-ACACefuroxime Impurity C95
데이터베이스 식별자
- CAS
27920-90-7- PubChem CID
- 446570
- DTXSID
DTXSID40182197- ChEBI
CHEBI:41425- Nikkaji
- J431.584G
물성
구조 계산 물성
- XLogP
- -1.7
- 극성 표면적
- 176 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 689
물리화학적 성질
- 끓는 점
- 803.3 · 803.3±65.0 °C(Predicted)
- 밀도
- 1.56 · 1.56±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 2.68 · 2.68±0.50(Predicted)
화학 및 산업
공급사3 곳
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
관련 반응
10건
연결된 노트
불러오는 중…