Water → HCID 53251330, compound

HRID 1133472Notes

Reaction equation

HRID 1133472 reaction equation
[CH3:1][O:2][C:3](=[O:4])[n:5]1[n:6][cH:7][c:8]2[c:9]([NH:14][C:15](=[O:16])[NH:17][CH:18]3[CH2:19][CH2:20][O:21][c:22]4[cH:23][cH:24][c:25]([CH3:28])[cH:26][c:27]43)[cH:10][cH:11][cH:12][c:13]12.[CH3:29][O:30][C:31]([n:32]1[c:33]2[c:34]([c:35]([NH:36][C:37]([NH:38][CH:39]3[c:40]4[c:41]([cH:42][c:43]([C:44]([CH3:45])([CH3:46])[CH3:47])[cH:48][cH:49]4)[O:50][CH2:51][CH2:52]3)=[O:53])[cH:54][cH:55][cH:56]2)[cH:57][n:58]1)=[O:59].[OH2:60]>>[nH:5]1[n:6][cH:7][c:8]2[c:9]([NH:14][C:15](=[O:16])[NH:17][CH:18]3[CH2:19][CH2:20][O:21][c:22]4[cH:23][cH:24][c:25]([CH3:28])[cH:26][c:27]43)[cH:10][cH:11][cH:12][c:13]12

Participants

4

Reactant 3

HCID 962WaterHCID 67236084HCID 67236084, compoundHCID 67236455HCID 67236455, compound

Product 1

HCID 53251330HCID 53251330, compound

Sources & evidence

ORD record
ord-ec9fce861e824df295cdaa61aff77de4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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