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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Hydrochloric Acid → 10-(2,5-Diazabicyclo[2.2.2]oct-2-yl)-9-fluoro-2,3-dihydro-3-methyl-7-oxo-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid

HRID 141009
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인쇄 미리보기

반응식

HRID 141009 반응식
[CH3:42][C:43]#[N:44].[CH:23]12[NH:24][CH2:25][CH:26]([NH:27][CH2:28]1)[CH2:29][CH2:30]2.[ClH:21].[ClH:22].[F:1][c:2]1[c:3]([F:20])[c:4]2[c:5]3[n:6]([cH:11][c:12]([C:17](=[O:18])[OH:19])[c:13](=[O:16])[c:14]3[cH:15]1)[CH:7]([CH3:10])[CH2:8][O:9]2.[N:31]12[CH2:32][CH2:33][CH2:34][N:35]=[C:36]1[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]2>>[F:1][c:2]1[c:3]([N:24]2[CH:23]3[CH2:28][NH:27][CH:26]([CH2:25]2)[CH2:29][CH2:30]3)[c:4]2[c:5]3[n:6]([cH:11][c:12]([C:17](=[O:18])[OH:19])[c:13](=[O:16])[c:14]3[cH:15]1)[CH:7]([CH3:10])[CH2:8][O:9]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric Acid2회HCID 6342AcetonitrileHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 4233472,5-Diazabicyclo(2.2.2)octaneHCID 5342788,9-Difluoro-3-methyl-6-oxo-2,3-dihydro-6H-1-oxa-3a-aza-phenalene-5-carboxylic acid

생성물 1

HCID 13565840
10-(2,5-Diazabicyclo[2.2.2]oct-2-yl)-9-fluoro-2,3-dihydro-3-methyl-7-oxo-7H-pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid

출처 및 근거

ORD 기록
ord-9226abb7812a462faa6c224b55d2e99e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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