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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Hydrochloric Acid → 9-Fluoro-2,3-dihydro-3-methyl-10-(7-methyl-2,7-diazaspiro[4.4]non-2-yl)-7-oxo-7H-pyrido[1,2,3-de]1,4-benzoxazine-6-carboxylic acid

HRID 100577
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인쇄 미리보기

반응식

HRID 100577 반응식
[CH3:3][N:4]1[CH2:5][C:6]2([CH2:7][CH2:8]1)[CH2:9][NH:10][CH2:11][CH2:12]2.[CH3:44][C:45]#[N:46].[ClH:1].[ClH:2].[F:24][c:25]1[c:26]([F:43])[c:27]2[c:28]3[n:29]([cH:34][c:35]([C:40](=[O:41])[OH:42])[c:36](=[O:39])[c:37]3[cH:38]1)[CH:30]([CH3:33])[CH2:31][O:32]2.[N:13]12[CH2:14][CH2:15][CH2:16][N:17]=[C:18]1[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2>>[CH3:3][N:4]1[CH2:5][C:6]2([CH2:7][CH2:8]1)[CH2:9][N:10]([c:26]1[c:25]([F:24])[cH:38][c:37]3[c:28]4[c:27]1[O:32][CH2:31][CH:30]([CH3:33])[n:29]4[cH:34][c:35]([C:40](=[O:41])[OH:42])[c:36]3=[O:39])[CH2:11][CH2:12]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric Acid2회HCID 6342AcetonitrileHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 5342788,9-Difluoro-3-methyl-6-oxo-2,3-dihydro-6H-1-oxa-3a-aza-phenalene-5-carboxylic acidHCID 47135002-Methyl-2,7-diazaspiro(4.4)nonane

생성물 1

HCID 13772841
9-Fluoro-2,3-dihydro-3-methyl-10-(7-methyl-2,7-diazaspiro[4.4]non-2-yl)-7-oxo-7H-pyrido[1,2,3-de]1,4-benzoxazine-6-carboxylic acid

출처 및 근거

ORD 기록
ord-7da101e427e24d6dbba716fcbf37066b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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