Ammonium → HCID 11225063, compound

HRID 281322Notes

Reaction equation

HRID 281322 reaction equation
[CH3:48][CH2:49][OH:50].[CH:1]([CH3:2])([CH3:3])[S:4](=[O:5])(=[O:6])[n:7]1[c:8]([NH2:43])[n:9][c:10]2[c:11]1[cH:12][c:13](-[c:16]1[n:17][c:18]([CH:27]3[CH2:28][CH2:29][N:30]([C:33]([O:34][CH2:35][c:36]4[cH:37][cH:38][cH:39][cH:40][cH:41]4)=[O:42])[CH2:31][CH2:32]3)[nH:19][c:20]1-[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[cH:14][cH:15]2.[CH:44]([O-:45])=[O:46].[NH4+:47]>>[CH:1]([CH3:2])([CH3:3])[S:4](=[O:5])(=[O:6])[n:7]1[c:8]([NH2:43])[n:9][c:10]2[c:11]1[cH:12][c:13](-[c:16]1[n:17][c:18]([CH:27]3[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]3)[nH:19][c:20]1-[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[cH:14][cH:15]2

Participants

5

Reactant 4

HCID 223AmmoniumHCID 283FormateHCID 702EthanolHCID 17981625HCID 17981625, compound

Product 1

HCID 11225063HCID 11225063, compound

Sources & evidence

ORD record
ord-4f55b80c0e194d80b04a036b7c45b976
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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