Water → HCID 73854979, compound

HRID 677128Notes

Reaction equation

HRID 677128 reaction equation
[CH2:67]1[O:68][CH2:69][CH2:70][CH2:71]1.[N:1](=[N+:2]=[N-:3])[CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:46]1)[N:12]([CH3:45])[C:13](=[C:15]1[C:16](=[O:44])[N:17]([CH2:37][c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[C:18](=[N:20][c:21]3[cH:22][c:23]([NH:30][C:31]([CH2:32][N:33]([CH3:34])[CH3:35])=[O:36])[cH:24][cH:25][c:26]3[NH:27][CH2:28][CH3:29])[S:19]1)[S:14]2.[OH2:66].[c:47]1([P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[NH2:1][CH2:4][CH2:5][O:6][c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:46]1)[N:12]([CH3:45])[C:13](=[C:15]1[C:16](=[O:44])[N:17]([CH2:37][c:38]3[cH:39][cH:40][cH:41][cH:42][cH:43]3)[C:18](=[N:20][c:21]3[cH:22][c:23]([NH:30][C:31]([CH2:32][N:33]([CH3:34])[CH3:35])=[O:36])[cH:24][cH:25][c:26]3[NH:27][CH2:28][CH3:29])[S:19]1)[S:14]2

Participants

5

Sources & evidence

ORD record
ord-798c344122ce482a94f70e4254387113
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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