Water → HCID 54452430, compound

HRID 179502Notes

Reaction equation

HRID 179502 reaction equation
[CH3:32][C:33]([CH3:34])([CH3:35])[c:36]1[cH:37][cH:38][c:39](-[c:42]2[c:43]([SH:47])[n:44][n:45][s:46]2)[cH:40][cH:41]1.[CH:1]12[S:2][CH2:3][C:4]([CH2:5][O:6][C:7](=[O:8])[CH3:9])=[C:10]([C:28]([OH:29])=[O:30])[N:11]1[C:12](=[O:13])[CH:14]2[NH:15][C:16](=[O:17])[C:18](=[N:19][O:20][CH3:21])[c:22]1[cH:23][s:24][c:25]([NH2:26])[n:27]1.[K:48].[Na:31].[OH2:49]>>[CH:1]12[S:2][CH2:3][C:4]([CH2:5][S:47][c:43]3[c:42](-[c:39]4[cH:38][cH:37][c:36]([C:33]([CH3:32])([CH3:34])[CH3:35])[cH:41][cH:40]4)[s:46][n:45][n:44]3)=[C:10]([C:28]([OH:29])=[O:30])[N:11]1[C:12](=[O:13])[CH:14]2[NH:15][C:16](=[O:17])[C:18](=[N:19][O:20][CH3:21])[c:22]1[cH:23][s:24][c:25]([NH2:26])[n:27]1

Participants

6

Reactant 5

HCID 962WaterHCID 26323-((Acetyloxy)methyl)-7-(2-(2-amino-1,3-thiazol-4-yl)(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acidHCID 5360545SodiumHCID 5462222PotassiumHCID 14294241HCID 14294241, compound

Product 1

HCID 54452430HCID 54452430, compound

Sources & evidence

ORD record
ord-bb2e5b2659b3483c82e3652afc292190
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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