Acetate → HCID 67253050, compound

HRID 2125945Notes

Reaction equation

HRID 2125945 reaction equation
[C:1](#[N:2])[c:3]1[n:4][cH:5][cH:6][c:7]([O:9][c:10]2[cH:11][c:12]([F:38])[c:13]([NH:16][C:17](=[O:18])[NH:19][c:20]3[cH:21][c:22]([CH:35]([CH3:36])[CH3:37])[n:23][n:24]3-[c:25]3[cH:26][c:27]4[cH:28][cH:29][cH:30][n:31][c:32]4[cH:33][cH:34]3)[cH:14][cH:15]2)[cH:8]1.[C:39]([NH:42][CH:40]([C:41]([OH:43])=[O:44])[CH2:45][SH:46])(=[O:47])[CH3:48].[CH3:50][C:51](=[O:52])[O-:53].[CH3:60][OH:61].[K+:54].[K+:55].[NH4+:49].[O-:56][C:57]([O-:58])=[O:59].[OH2:62]>>[C:1]([NH2:2])([c:3]1[n:4][cH:5][cH:6][c:7]([O:9][c:10]2[cH:11][c:12]([F:38])[c:13]([NH:16][C:17](=[O:18])[NH:19][c:20]3[cH:21][c:22]([CH:35]([CH3:36])[CH3:37])[n:23][n:24]3-[c:25]3[cH:26][c:27]4[cH:28][cH:29][cH:30][n:31][c:32]4[cH:33][cH:34]3)[cH:14][cH:15]2)[cH:8]1)=[NH:42]

Participants

9

Reactant 8

HCID 175AcetateHCID 223AmmoniumHCID 581N-Acetyl-DL-cysteineHCID 813Potassium Cation2×HCID 887MethanolHCID 962WaterHCID 19660Carbonate IonHCID 67251803HCID 67251803, compound

Product 1

HCID 67253050HCID 67253050, compound

Sources & evidence

ORD record
ord-9cc3a4089fd74f2c9e9e4e93dc9b3fc8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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