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Potassium Cation → 2-[3-(2-tert-butoxycarbonylaminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-2-methylpropionic acid

HRID 152720
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반응식

HRID 152720 반응식
[CH2:3]([CH3:4])[O:5][C:6]([C:7]([CH3:8])([CH3:9])[c:10]1[cH:11][c:12]2[c:13]([CH2:27][CH2:28][NH:29][C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[c:14](-[c:19]3[cH:20][c:21]([CH3:26])[cH:22][c:23]([CH3:25])[cH:24]3)[nH:15][c:16]2[cH:17][cH:18]1)=[O:37].[K+:2].[OH-:1]>>[O:5]=[C:6]([C:7]([CH3:8])([CH3:9])[c:10]1[cH:11][c:12]2[c:13]([CH2:27][CH2:28][NH:29][C:30](=[O:31])[O:32][C:33]([CH3:34])([CH3:35])[CH3:36])[c:14](-[c:19]3[cH:20][c:21]([CH3:26])[cH:22][c:23]([CH3:25])[cH:24]3)[nH:15][c:16]2[cH:17][cH:18]1)[OH:37]
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반응물 3

HCID 813Potassium CationHCID 961HydroxideHCID 154585222-[3-(2-tert-Butoxycarbonylaminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-2-methylpropionic acid ethylester

생성물 1

HCID 154585232-[3-(2-tert-butoxycarbonylaminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-2-methylpropionic acid

출처 및 근거

ORD 기록
ord-33c7ef1ba6204e259792207ee9826e6a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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