Water → HCID 68587925, compound

HRID 1120590Notes

Reaction equation

HRID 1120590 reaction equation
[CH3:40][N:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[NH2:26][CH:27]1[CH2:28][CH2:29][N:30]([C:33](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[CH2:31][CH2:32]1.[OH2:47].[c:1]1(-[c:7]2[cH:8][cH:9][cH:10][c:11]3[n:12]2[n:13][c:14]([NH:16][c:17]2[cH:18][cH:19][c:20]([C:21](=[O:22])[OH:23])[cH:24][cH:25]2)[n:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[cH:8][cH:9][cH:10][c:11]3[n:12]2[n:13][c:14]([NH:16][c:17]2[cH:18][cH:19][c:20]([C:21](=[O:22])[NH:26][CH:27]4[CH2:28][CH2:29][N:30]([C:33](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[CH2:31][CH2:32]4)[cH:24][cH:25]2)[n:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Sources & evidence

ORD record
ord-4e1a3aaf70164ec99f9de73a94b4343e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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