Methanol → HCID 21190717, compound

HRID 2326444Notes

Reaction equation

HRID 2326444 reaction equation
[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[CH3:45][OH:46].[Cl:1][c:2]1[cH:3][c:4]([NH:8][c:9]2[c:10]3[c:11]([n:12][cH:13][n:14]2)[nH:15][n:16][c:17]3[N:18]=[CH:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[cH:27][n:28][cH:29][cH:30][cH:31]3)[cH:24][cH:25]2)[cH:5][cH:6][cH:7]1.[Na+:38].[Na+:39].[O-:40][S:41]([O-:42])(=[O:43])=[O:44].[OH2:47]>>[Cl:1][c:2]1[cH:3][c:4]([NH:8][c:9]2[c:10]3[c:11]([n:12][cH:13][n:14]2)[nH:15][n:16][c:17]3[NH:18][CH2:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[cH:27][n:28][cH:29][cH:30][cH:31]3)[cH:24][cH:25]2)[cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 1117Sulfate IonHCID 8857Ethyl AcetateHCID 178478145HCID 178478145, compound

Product 1

HCID 21190717HCID 21190717, compound

Sources & evidence

ORD record
ord-ba7643736b4343ad852a85a961a15564
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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