Water → HCID 18444342, compound

HRID 1557439Notes

Reaction equation

HRID 1557439 reaction equation
[CH3:75][N:76]([CH3:77])[CH:78]=[O:79].[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[O:10]=[c:11]1[nH:12][n:13][c:14]([CH2:21][c:22]2[cH:23][c:24]([NH:28][C:29]([CH2:30][CH:31]([C:32](=[O:33])[OH:34])[c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)=[O:41])[cH:25][cH:26][cH:27]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12.[O:42]=[c:43]1[c:44]2[c:45]([cH:46][cH:47][cH:48][cH:49]2)[c:50]([CH2:51][c:52]2[cH:53][c:54]([NH:55][C:56](=[O:57])[CH:58]([c:59]3[cH:60][cH:61][cH:62][cH:63][cH:64]3)[CH2:65][C:66]([OH:67])=[O:68])[cH:69][cH:70][cH:71]2)[n:72][nH:73]1.[OH2:74]>>[O:10]=[c:11]1[nH:12][n:13][c:14]([CH2:21][c:22]2[cH:23][c:24]([N:28]3[C:29](=[O:41])[CH2:30][CH:31]([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[C:32]3=[O:34])[cH:25][cH:26][cH:27]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 18444385HCID 18444385, compoundHCID 18444386HCID 18444386, compound

Product 1

HCID 18444342HCID 18444342, compound

Sources & evidence

ORD record
ord-119b150ed39a49328be92c4da790a7dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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