Water → HCID 178508489, compound

HRID 676897Notes

Reaction equation

HRID 676897 reaction equation
[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[CH3:75][N:76]([CH3:77])[CH:78]=[O:79].[CH:60]1([N:61]=[C:62]=[N:63][CH:64]2[CH2:65][CH2:66][CH2:67][CH2:68][CH2:69]2)[CH2:70][CH2:71][CH2:72][CH2:73][CH2:74]1.[NH2:1][c:2]1[n:3][c:4]([CH2:9][n:10]2[n:11][cH:12][c:13]3[cH:14][c:15]([C:19](=[O:20])[NH:21][CH2:22][CH:23]([C:24](=[O:25])[O:26][CH3:27])[NH:28][S:29](=[O:30])(=[O:31])[c:32]4[cH:33][cH:34][cH:35][c:36]5[cH:37][cH:38][cH:39][cH:40][c:41]45)[cH:16][cH:17][c:18]23)[cH:5][c:6](=[O:8])[nH:7]1.[OH2:49].[OH:50][n:51]1[c:52]2[cH:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1>>[NH2:1][c:2]1[n:3][c:4]([CH2:9][n:10]2[n:11][cH:12][c:13]3[cH:14][c:15]([C:19](=[O:20])[NH:21][CH2:22][CH:23]([C:24](=[O:25])[OH:26])[NH:28][S:29](=[O:30])(=[O:31])[c:32]4[cH:33][cH:34][cH:35][c:36]5[cH:37][cH:38][cH:39][cH:40][c:41]45)[cH:16][cH:17][c:18]23)[cH:5][c:6](=[O:8])[nH:7]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 10868DicyclohexylcarbodiimideHCID 757711-HydroxybenzotriazoleHCID 178500819HCID 178500819, compound

Product 1

HCID 178508489HCID 178508489, compound

Sources & evidence

ORD record
ord-1ca15967313c4e048d3353da2a2e4944
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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