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Hydrochloric Acid → 5-(2-Hydroxycarbonylmethyloxyphenyl)-4-(2,2-dimethylpropionyl)-3-hydroxy-1-(4-thiophene-3-ylphenyl)-1,5-dihydropyrrole-2-one

HRID 114080
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HRID 114080 반응식
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH3:1][C:2]([C:3](=[O:4])[C:5]1=[C:6]([OH:34])[C:7](=[O:33])[N:8]([c:22]2[cH:23][cH:24][c:25](-[c:28]3[cH:29][s:30][cH:31][cH:32]3)[cH:26][cH:27]2)[CH:9]1[c:10]1[c:11]([O:16][CH2:17][C:18](=[O:19])[O:20][CH3:21])[cH:12][cH:13][cH:14][cH:15]1)([CH3:35])[CH3:36].[CH3:46][OH:47].[ClH:44].[Li+:42].[OH-:43].[OH2:45]>>[CH3:1][C:2]([C:3](=[O:4])[C:5]1=[C:6]([OH:34])[C:7](=[O:33])[N:8]([c:22]2[cH:23][cH:24][c:25](-[c:28]3[cH:29][s:30][cH:31][cH:32]3)[cH:26][cH:27]2)[CH:9]1[c:10]1[c:11]([O:16][CH2:17][C:18](=[O:19])[OH:20])[cH:12][cH:13][cH:14][cH:15]1)([CH3:35])[CH3:36]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 583653294-(2,2-Dimethylpropionyl)-3-hydroxy-5-(2-methoxycarbonylmethyloxyphenyl)-1-(4-thiophene-3-ylphenyl)-1,5-dihydropyrrole-2-one

생성물 1

HCID 583657045-(2-Hydroxycarbonylmethyloxyphenyl)-4-(2,2-dimethylpropionyl)-3-hydroxy-1-(4-thiophene-3-ylphenyl)-1,5-dihydropyrrole-2-one

출처 및 근거

ORD 기록
ord-2cb0a575bf6e4863a1c14249726c586e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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