(2R,3R,4S,5R)-5-(2,6-diaminopurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol

HCID 460081
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Nc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)c2n1
InChIKey
MHWHYOFBOWTAHZ-AYQXTPAHSA-N
분자식
C10H13FN6O3
평균 분자량
284.25 g/mol
단동위원소 질량
284.10331646

이름 및 식별자

우선 이름
(2R,3R,4S,5R)-5-(2,6-diaminopurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol
IUPAC
(2R,3R,4S,5R)-5-(2,6-diaminopurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol

이름 및 동의어

103884-97-5(2R,3R,4S,5R)-5-(2,6-Diamino-9H-purin-9-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol(2R,3R,4S,5R)-5-(2,6-diaminopurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol2,6-Diamino-9-(2'-deoxy-2'-fluoro-beta-d-arabinofuranosyl)purine9H-Purine-2,6-diamine, 9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2'-FANA-DAP(2R,3R,4S,5R)-5-(2,6-diamino-9H-purin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-olMHWHYOFBOWTAHZ-AYQXTPAHSA-N2,6-Diamino-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-9H-purineorb1908887SCHEMBL5709816TNU0083
이름 더 보기
ND09537DA-50043F864272,6-Diamino-9-(2'-deoxy-2'-fluoro-b-D-arabinofuranosyl)purine2,6-DiaMinopurine-9-beta-D-(2'-deoxy-2'-fluoro)-arabinoriboside9H-Purine-2,6-diamine,9-(2-deoxy-2-fluoro-.beta.-D-arabinofuranosyl)-(2R,3R,4S,5R)-5-(2,6-diaminopurin-9-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol

데이터베이스 식별자

PubChem CID
460081
Nikkaji
J670.948F

물성

구조 계산 물성

XLogP
-0.4
극성 표면적
145 Ų
수소 결합 공여자 수
4
수소 결합 수용자 수
9
회전 가능 결합 수
2
무거운 원자 수
20

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