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Hydroxide → (+/-)-5,6,6a,7-tetrahydro-2,3-dimethoxy-9,10-methylenedioxy-5-methyl-4H-dibenz(de,g)isoquinoline

HRID 153392
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인쇄 미리보기

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HRID 153392 반응식
[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[O:50]=[CH:51][N:52]([CH3:53])[CH3:54].[OH-:39].[OH:8][c:9]1[c:10]([O:30][CH3:31])[cH:11][c:12]2[c:13]3[c:14]1[CH2:15][N:16]([CH3:29])[CH2:17][CH:18]3[CH2:19][c:20]1[c:21]-2[cH:22][c:23]2[c:24]([cH:25]1)[O:26][CH2:27][O:28]2.[c:40]1([N+:41]([CH3:42])([CH3:43])[CH3:44])[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[CH3:2][O:8][c:9]1[c:10]([O:30][CH3:31])[cH:11][c:12]2[c:13]3[c:14]1[CH2:15][N:16]([CH3:29])[CH2:17][CH:18]3[CH2:19][c:20]1[c:21]-2[cH:22][c:23]2[c:24]([cH:25]1)[O:26][CH2:27][O:28]2
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 961HydroxideHCID 1140TolueneHCID 6228DimethylformamideHCID 6422Trifluoroacetic acidHCID 15914PhenyltrimethylammoniumHCID 1280207718-Methoxy-14-methyl-5,7-dioxa-14-azapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),9,16(20),17-hexaen-17-ol

생성물 1

HCID 12802078
(+/-)-5,6,6a,7-tetrahydro-2,3-dimethoxy-9,10-methylenedioxy-5-methyl-4H-dibenz(de,g)isoquinoline

출처 및 근거

ORD 기록
ord-a690380f7cd443ab98486307b6acbbe8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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