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Hydrochloric Acid → 3-[3-[[3-Methoxy-4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxy]-1-phenylpyrazol-5-yl]prop-2-enoic acid

HRID 2323211
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HRID 2323211 반응식
[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][O:7][c:8]2[n:9][n:10](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[c:11]([CH:13]=[CH:14][C:15](=[O:16])[O:17][CH2:18][CH3:19])[cH:12]2)[cH:26][cH:27][c:28]1[O:29][CH2:30][c:31]1[n:32][c:33](-[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[o:34][c:35]1[CH3:36].[CH3:51][CH2:52][OH:53].[ClH:50].[Na+:44].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH-:43]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][O:7][c:8]2[n:9][n:10](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[c:11]([CH:13]=[CH:14][C:15](=[O:16])[OH:17])[cH:12]2)[cH:26][cH:27][c:28]1[O:29][CH2:30][c:31]1[n:32][c:33](-[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[o:34][c:35]1[CH3:36]
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반응물 6

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 90828846Ethyl 3-[3-[[3-methoxy-4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxy]-1-phenylpyrazol-5-yl]prop-2-enoate

생성물 1

HCID 69217881
3-[3-[[3-Methoxy-4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxy]-1-phenylpyrazol-5-yl]prop-2-enoic acid

출처 및 근거

ORD 기록
ord-c09bd3eb40b44aea8398ed7c2e475224
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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