Water → HCID 22344385, compound

HRID 165815Notes

Reaction equation

HRID 165815 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:10]([c:11]3[c:12]1[O:13][C:14]([CH3:16])([CH3:17])[CH2:15]3)[C:9]([c:18]1[cH:19][c:20](-[c:24]3[cH:25][cH:26][c:27]([NH2:30])[cH:28][cH:29]3)[cH:21][cH:22][cH:23]1)=[N:8][C:7]([CH3:31])([CH3:32])[CH2:6]2.[CH3:33][C:34](=[O:35])[NH:36][CH2:37][C:38]([OH:39])=[O:40].[CH3:52][N:53]([CH3:54])[CH:55]=[O:56].[OH2:51].[OH:41][n:42]1[c:43]2[cH:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:10]([c:11]3[c:12]1[O:13][C:14]([CH3:16])([CH3:17])[CH2:15]3)[C:9]([c:18]1[cH:19][c:20](-[c:24]3[cH:25][cH:26][c:27]([NH:30][C:38]([CH2:37][NH:36][C:34]([CH3:33])=[O:35])=[O:39])[cH:28][cH:29]3)[cH:21][cH:22][cH:23]1)=[N:8][C:7]([CH3:31])([CH3:32])[CH2:6]2

Participants

6

Sources & evidence

ORD record
ord-5199af484c5742d6a1887eaad9a290db
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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