Methanol → HCID 18403511, compound

HRID 1114704Notes

Reaction equation

HRID 1114704 reaction equation
[CH3:12][n:13]1[cH:14][c:15]([C:22]2=[C:26]([c:27]3[cH:28][c:29]([S:33][CH2:34][CH:35]4[O:36][C:37]([CH3:40])([CH3:41])[O:38][CH2:39]4)[cH:30][cH:31][cH:32]3)[C:25](=[O:42])[NH:24][C:23]2=[O:43])[c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]12.[CH3:44][OH:45].[OH2:46].[c:1]1([CH3:2])[c:3]([S:4]([OH:5])(=[O:6])=[O:7])[cH:8][cH:9][cH:10][cH:11]1>>[CH3:12][n:13]1[cH:14][c:15]([C:22]2=[C:26]([c:27]3[cH:28][c:29]([S:33][CH2:34][CH:35]([OH:36])[CH2:39][OH:38])[cH:30][cH:31][cH:32]3)[C:25](=[O:42])[NH:24][C:23]2=[O:43])[c:16]2[cH:17][cH:18][cH:19][cH:20][c:21]12

Participants

5

Reactant 4

HCID 887MethanolHCID 962WaterHCID 69252-Methylbenzenesulfonic acidHCID 18403503HCID 18403503, compound

Product 1

HCID 18403511HCID 18403511, compound

Sources & evidence

ORD record
ord-71f30c76c35c46cba80d2b744a88de7f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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