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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Methyl 3-(bromomethyl)benzoate → methyl 3-[(2'-oxo-5,6-dihydrospiro[benzo[1,2-b:5,4-b']difuran-3,3'-indol]-1'(2'H)-yl)methyl]benzoate

HRID 203313
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HRID 203313 반응식
[Br:44][CH2:45][c:46]1[cH:47][c:48]([C:49](=[O:50])[O:51][CH3:52])[cH:53][cH:54][cH:55]1.[Br:56][CH2:57][c:58]1[o:59][c:60]([C:61]([F:62])([F:63])[F:64])[cH:65][cH:66]1.[CH3:22][c:23]1[c:24]2[cH:25][c:26]3[c:39]([cH:40][c:41]2[o:42][n:43]1)[O:38][CH2:37][C:27]31[c:28]2[c:29]([cH:30][cH:31][cH:32][cH:33]2)[NH:34][C:35]1=[O:36].[NH:1]1[C:2](=[O:21])[C:3]2([c:4]3[c:5]([cH:8][c:9]4[c:13]([cH:14]3)[CH2:12][CH2:11][O:10]4)[O:6][CH2:7]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]21>>[N:1]1([CH2:45][c:46]2[cH:47][c:48]([C:49](=[O:50])[O:51][CH3:52])[cH:53][cH:54][cH:55]2)[C:2](=[O:21])[C:3]2([c:4]3[c:5]([cH:8][c:9]4[c:13]([cH:14]3)[CH2:12][CH2:11][O:10]4)[O:6][CH2:7]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]21
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 517981Methyl 3-(bromomethyl)benzoateHCID 27946052-(Bromomethyl)-5-(trifluoromethyl)furanHCID 592633545,6-dihydro-2H-spiro[benzofuro[6,5-b]furan-3,3'-indolin]-2'-oneHCID 593524533-methylspiro[furo[3,2-f][1,2]benzisoxazole-5,3'-indol]-2'(1H)-one

생성물 1

HCID 59352357methyl 3-[(2'-oxo-5,6-dihydrospiro[benzo[1,2-b:5,4-b']difuran-3,3'-indol]-1'(2'H)-yl)methyl]benzoate

출처 및 근거

ORD 기록
ord-f32a862f61064b76b00cccd844809c3f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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