Bicarbonate Ion → HCID 57541250, compound

HRID 169349Notes

Reaction equation

HRID 169349 reaction equation
[C:46](=[O:47])([O-:48])[OH:49].[CH3:12][n:13]1[n:14][cH:15][c:16](-[c:18]2[cH:19][c:20]3[c:21]([n:22][cH:23]2)[cH:24][cH:25][c:26]2[c:27]([c:28]3=[O:29])[cH:30][c:31]([CH2:34][S:35](=[O:36])(=[O:37])[NH:38][CH2:39][c:40]3[n:41][cH:42][cH:43][cH:44][cH:45]3)[cH:32][cH:33]2)[cH:17]1.[Cl:51][CH2:52][Cl:53].[Na+:50].[OH:1][O:2][C:3]([c:4]1[cH:5][c:6]([Cl:7])[cH:8][cH:9][cH:10]1)=[O:11]>>[O-:1][n+:41]1[c:40]([CH2:39][NH:38][S:35]([CH2:34][c:31]2[cH:30][c:27]3[c:26]([cH:25][cH:24][c:21]4[c:20]([cH:19][c:18](-[c:16]5[cH:15][n:14][n:13]([CH3:12])[cH:17]5)[cH:23][n:22]4)[c:28]3=[O:29])[cH:33][cH:32]2)(=[O:36])=[O:37])[cH:45][cH:44][cH:43][cH:42]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 70297m-Chloroperbenzoic acidHCID 45142457MK-8033

Product 1

HCID 57541250HCID 57541250, compound

Sources & evidence

ORD record
ord-3f1ad8990400486aab3e8cf45aa1a272
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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