5'-(4-Iodo-3-methyl-phenylcarbamoyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-carboxylic acid → 1-[4-(1-Ethyl-1H-indol-6-ylcarbamoyl)-phenyl]-piperidine-4-carboxylic acid

반응식

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH2:7][CH2:8][N:9]([c:12]2[cH:13][cH:14][c:15]([C:18]([NH:19][c:20]3[cH:21][cH:22][c:23]4[cH:24][cH:25][n:26]([CH2:29][CH3:30])[c:27]4[cH:28]3)=[O:31])[cH:16][cH:17]2)[CH2:10][CH2:11]1.[I:32][c:33]1[cH:34][cH:35][c:36]([NH:37][C:38]([c:39]2[cH:40][cH:41][c:42]([N:43]3[CH2:44][CH2:45][CH:46]([C:47]([OH:48])=[O:49])[CH2:50][CH2:51]3)[n:52][cH:53]2)=[O:54])[cH:55][c:56]1[CH3:57]>>[O:3]=[C:4]([OH:5])[CH:6]1[CH2:7][CH2:8][N:9]([c:12]2[cH:13][cH:14][c:15]([C:18]([NH:19][c:20]3[cH:21][cH:22][c:23]4[cH:24][cH:25][n:26]([CH2:29][CH3:30])[c:27]4[cH:28]3)=[O:31])[cH:16][cH:17]2)[CH2:10][CH2:11]1

참가 물질

반응물 2

HCID 593179955'-(4-Iodo-3-methyl-phenylcarbamoyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyridinyl-4-carboxylic acid

HCID 59318122HCID 59318122, 화합물

생성물 1

HCID 593180471-[4-(1-Ethyl-1H-indol-6-ylcarbamoyl)-phenyl]-piperidine-4-carboxylic acid

출처 및 근거

ORD 기록: ord-e2ead1a1cc1c4e978a4ab2e246e50821
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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