기본 정보
- CAS
25520-83-6- 표준 SMILES
Cc1cn([C@H]2C[C@H](F)[C@@H](COP(=O)(O)O)O2)c(=O)[nH]c1=O- InChIKey
GGCAVPJXJISBOA-XLPZGREQSA-N- 분자식
- C10H14FN2O7P
- 평균 분자량
- 324.2 g/mol
- 단동위원소 질량
- 324.05226595
개요
3'-fluoro-3'-deoxythymidine 5'-monophosphate has been reported in Streptomyces anthocyanicus, Streptomyces lividans, and Streptomyces albus with data available.
이름 및 식별자
- 우선 이름
- 3'-Fluoro-3'-deoxythymidine 5'-monophosphate
- IUPAC
- [(2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
- 현지명
- 3'-플루오로-3'-데옥시티미딘모노포스페이트
- 영어명
- 3'-Fluoro-3'-deoxythymidine Monophosphate
- 분자식
- C10H14FN2O7P
- 분자량
- 324.2
이름 및 동의어
3'-Fluoro-3'-deoxythymidine 5'-monophosphate25520-83-63'-Deoxy-3'-fluorothymidine monophosphateUNII-K6W0IAP44BK6W0IAP44B3'-Fluoro-3'-deoxythymidine 5'-phosphate5'-Thymidylic acid, 3'-deoxy-3'-fluoro-Uridine, 2',3'-dideoxy-3'-fluoro-5-methyl-, 5'-(dihydrogen phosphate)[(2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate{[(2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}phosphonic acid(((2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl)methoxy)phosphonic acid((2R,3S,5R)-3-fluoro-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl)methyl dihydrogen phosphate
이름 더 보기
3'-플루오로-3'-데옥시티미딘모노포스페이트Gxn208363'-Deoxy-3'-fluoro-5'-thymidylic Acid3’-Deoxy-3’-fluorothymidine-5’-monophosphate2',3'-dideoxy-3'-fluoro-5-methyluridine 5'-(Dihydrogen Phosphate)
RefChem:903943'-FLUORO-3'-DEOXYTHYMIDINE MONOPHOSPHATEFDMorb2813851SCHEMBL4747720CHEMBL1160619TN8356DB03195
데이터베이스 식별자
- CAS
25520-83-6- PubChem CID
- 447405
- ChEMBL
CHEMBL1160619- UNII
- K6W0IAP44B
- Nikkaji
- J1.169.338E
물성
구조 계산 물성
- XLogP
- -1.4
- 극성 표면적
- 125 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 533
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Listed in ZINC15
화학 및 산업
응용 분야
용도A thymidine-5O-monophosphate analogue as inhibitors of Mycobacterium tuberculosis thymidylate kinase.
상·하류 제품 정보
상류 원료
공급사1 곳
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