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Water → HCID 59559661, 화합물

HRID 2345015
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HRID 2345015 반응식
[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][c:18]1[c:19]([C:20](=[O:21])[OH:22])[cH:23][cH:24][cH:25][cH:26]1.[CH3:37][CH2:38][N:39]=[C:40]=[N:41][CH2:42][CH2:43][CH2:44][N:45]([CH3:46])[CH3:47].[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[O:48]=[C:49]([CH2:50][NH:51][C:52](=[O:53])[c:54]1[cH:55][cH:56][c:57](-[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[cH:58][cH:59]1)[N:66]1[CH2:67][CH2:68][NH:69][CH2:70][CH2:71]1.[O:72]=[CH:73][N:74]([CH3:75])[CH3:76].[OH2:77].[OH:27][n:28]1[c:29]2[c:30]([cH:31][cH:32][cH:33][cH:34]2)[n:35][n:36]1>>[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[NH:17][c:18]1[c:19]([C:20](=[O:22])[N:69]2[CH2:68][CH2:67][N:66]([C:49](=[O:48])[CH2:50][NH:51][C:52](=[O:53])[c:54]3[cH:55][cH:56][c:57](-[c:60]4[cH:61][cH:62][cH:63][cH:64][cH:65]4)[cH:58][cH:59]3)[CH2:71][CH2:70]2)[cH:23][cH:24][cH:25][cH:26]1
참가 물질출처 및 근거반응 노트

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8

반응물 7

HCID 962WaterHCID 6228DimethylformamideHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 4087778Boc-2-Abz-OHHCID 57855677Biphenyl-4-carboxylicacid (2-oxo-2-piperazin-1-yl-ethyl)-amide

생성물 1

HCID 59559661HCID 59559661, 화합물

출처 및 근거

ORD 기록
ord-262428d537c7472daa11ce4e89aed03c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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