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Water → 2-(7-(3-Cyano-4-isopropoxybenzyloxy)-9-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-yl)acetic Acid

HRID 2349350
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반응식

HRID 2349350 반응식
[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][c:10]3[c:11]([CH3:28])[c:12]4[n:13]([c:14]3[cH:15][cH:16]2)[CH2:17][CH2:18][CH:19]4[CH2:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[cH:29][cH:30][c:31]1[O:32][CH:33]([CH3:34])[CH3:35].[CH3:44][CH2:45][O:46][CH2:47][CH3:48].[Cl:49][CH2:50][Cl:51].[F:36][C:37]([F:38])([F:39])[C:40]([OH:41])=[O:42].[OH2:43]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([CH2:6][O:7][c:8]2[cH:9][c:10]3[c:11]([CH3:28])[c:12]4[n:13]([c:14]3[cH:15][cH:16]2)[CH2:17][CH2:18][CH:19]4[CH2:20][C:21](=[O:22])[OH:23])[cH:29][cH:30][c:31]1[O:32][CH:33]([CH3:34])[CH3:35]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 962WaterHCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 67249930tert-Butyl 2-(7-(3-Cyano-4-isopropoxybenzyloxy)-9-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-yl)acetate

생성물 1

HCID 583296132-(7-(3-Cyano-4-isopropoxybenzyloxy)-9-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-1-yl)acetic Acid

출처 및 근거

ORD 기록
ord-7026a91555584458991e9de77f3495a5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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