기본 정보
- CAS
208711-44-8- 표준 SMILES
Cn1c(=O)c2[nH]c(CCCNC(=O)c3cc4ccc(O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)cc4oc3=O)nc2n(C)c1=O- InChIKey
PSHIXQHKZSNFIT-XHOFLWIVSA-N- 분자식
- C26H29N5O11
- 평균 분자량
- 587.5 g/mol
- 단동위원소 질량
- 587.18635676
개요
used for fluorescent immunoassay
이름 및 식별자
- 우선 이름
- 2H-1-Benzopyran-3-carboxamide, 7-(beta-D-galactopyranosyloxy)-2-oxo-N-(3-(2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)propyl)-
- IUPAC
- N-[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propyl]-2-oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromene-3-carboxamide
- 영어명
- R 848
- 분자식
- C17H22N4O2
- 분자량
- 314.38218
이름 및 동의어
beta-Galactosylumbelliferone theophylline79181-90-12H-1-Benzopyran-3-carboxamide, 7-(beta-D-galactopyranosyloxy)-2-oxo-N-(3-(2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)propyl)-RefChem:119376279-107-1GU-theophyllineEINECS 279-107-1N-[3-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)propyl]-2-oxo-7-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromene-3-carboxamideDTXSID80943128NS000609698-(3-(7-beta-galactosylcoumarin-3-carboxyamido)propyl)theophylline7-(beta-D-Galactopyranosyloxy)-2-oxo-N-(3-(2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)propyl)-2H-1-benzopyran-3-carboxamide
이름 더 보기
R 848S 28463Unii-V3dmu7pvxfResiquimod [inn]Resiquimod(Synonyms:R8481H-Imidazo(4,5-C)quinoline-1-ethanol, 4-amino-2-(ethoxymethyl)-alpha,alpha-dimethyl-
N-[3-(1,3-Dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)propyl]-7-(beta-D-galactopyranosyloxy)-2-oxo-2H-1-benzopyran-3-carboxamideN-[3-(1,3-Dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)propyl]-7-(I(2)-D-galactopyranosyloxy)-2-oxo-2H-1-benzopyran-3-carboxamide
물성
구조 계산 물성
- XLogP
- -0.2
- 극성 표면적
- 224 Ų
- 수소 결합 공여자 수
- 6
- 수소 결합 수용자 수
- 12
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 42
- 형식 전하
- 0
- 복잡도
- 1,110
화학 및 산업
공급사1 곳
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
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