Water → HCID 66745843, compound

HRID 283212Notes

Reaction equation

HRID 283212 reaction equation
[CH2:65]1[O:66][CH2:67][CH2:68][CH2:69]1.[N:1](=[N+:2]=[N-:3])[CH:4]1[CH2:5][CH:6]=[C:7]([c:10]2[cH:11][n:12][c:13]([NH:37][C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[c:14](-[c:16]3[n:17][n:18][c:19](-[c:21]4[cH:22][cH:23][c:24]([CH2:27][N:28]([C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH3:36])[cH:25][cH:26]4)[o:20]3)[n:15]2)[CH2:8][CH2:9]1.[OH2:64].[c:45]1([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1>>[NH2:1][CH:4]1[CH2:5][CH:6]=[C:7]([c:10]2[cH:11][n:12][c:13]([NH:37][C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[c:14](-[c:16]3[n:17][n:18][c:19](-[c:21]4[cH:22][cH:23][c:24]([CH2:27][N:28]([C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH3:36])[cH:25][cH:26]4)[o:20]3)[n:15]2)[CH2:8][CH2:9]1

Participants

5

Sources & evidence

ORD record
ord-80423c0ed8e6460181febe7b0c8d1a78
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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