기본 정보
- CAS
869355-24-8- 표준 SMILES
O=C(/C=C/c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]c1=O)ON1C(=O)CCC1=O- InChIKey
UCFQDCCIRGUDBE-OJJONNAYSA-N- 분자식
- C16H17N3O9
- 평균 분자량
- 395.32 g/mol
- 단동위원소 질량
- 395.09647913
이름 및 식별자
- 우선 이름
- Bis(2-cyanoethyl) ((2R,3S,5R)-2-(Hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl) Phosphate
- IUPAC
- (2,5-dioxopyrrolidin-1-yl) (E)-3-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]prop-2-enoate
- 현지명
- (E)-5-[2-(2-CARBOXYVINYL)]-2'-DEOXYURIDINEN-HYDROXY-SUCCIMIDE에스테르
- 영어명
- (E)-5-[2-(2-CARBOXYVINYL)]-2'-DEOXYURIDINE N-HYDROXY-SUCCIMIDE ESTER
- 분자식
- C16H17N3O9
- 분자량
- 395.32
이름 및 동의어
869355-24-8(2,5-Dioxopyrrolidin-1-yl) (E)-3-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]prop-2-enoate76759-76-7Bis(2-cyanoethyl) ((2R,3S,5R)-2-(Hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl) Phosphate5'-?O-?[Bis(4-?methoxyphenyl)?phenylmethyl]?-?3'-?Thymidylic Acid Bis(2-?cyanoethyl) EsterNC10421E-5-(2-Carboxyvinyl)-2'-deoxyuridine hydroxysuccinimide ester2'-Deoxy-5-[(1E)-3-[(2,5-dioxo-1-pyrrolidinyl)oxy]-3-oxo-1-propenyl]-(9CI)uridine5'-O-[Bis(4-methoxyphenyl)phenylmethyl]-3'-ThymidylicAcidBis(2-cyanoethyl)Ester(E)-5-[2-(2-CARBOXYVINYL)]-2'-DEOXYURIDINEN-HYDROXY-SUCCIMIDE에스테르(E)-5-[2-CARBOXYVINYL]-2'-DEOXYURIDINE NHS ESTER(E)-5-(2-Carboxyvinyl)-2'-deoxyuridine N-Hydroxysuccinimide Ester
이름 더 보기
(E)-5-[2-(2-CARBOXYVINYL)]-2'-DEOXYURIDINE N-HYDROXY-SUCCIMIDE ESTER2'-Deoxy-5-[(1E)-3-[(2,5-dioxo-1-pyrrolidinyl)oxy]-3-oxo-1-propenyl]uridine
물성
구조 계산 물성
- XLogP
- -2.1
- 극성 표면적
- 163 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 774
물리화학적 성질
- 밀도
- 1.67 · 1.67±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 8.46 · 8.46±0.10(Predicted)
화학 및 산업
응용 분야
용도(E)-5-(2-Carboxyvinyl)-2’-deoxyuridine N-Hydroxysuccinimide Ester is a derivative of 5-(2-Hydroxyethyl)-2’-deoxyuridine (H942060), which is a novel type of potent antiviral nucleoside analog.
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