Methanol → HCID 20816860, compound

HRID 1240886Notes

Reaction equation

HRID 1240886 reaction equation
[CH3:44][O-:45].[CH3:47][OH:48].[Na+:46].[O:1]=[S:2]1(=[O:43])[N:3]([c:8]2[c:9]3[cH:10][cH:11][cH:12][n:13][c:14]3[c:15](-[c:32]3[cH:33][c:34]([CH3:35])[cH:36][cH:37][c:38]3[S:39]([O-:40])(=[O:41])=[O:42])[c:16]([C:18](=[O:19])[NH:20][CH2:21][c:22]3[c:23]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:24][cH:25][cH:26][cH:27]3)[n:17]2)[CH2:4][CH2:5][CH2:6][CH2:7]1.[OH2:49]>>[O:1]=[S:2]1(=[O:43])[N:3]([c:8]2[c:9]3[cH:10][cH:11][cH:12][n:13][c:14]3[c:15]([OH:45])[c:16]([C:18](=[O:19])[NH:20][CH2:21][c:22]3[c:23]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:24][cH:25][cH:26][cH:27]3)[n:17]2)[CH2:4][CH2:5][CH2:6][CH2:7]1

Participants

6

Reactant 5

HCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 3826051MethoxideHCID 86587467HCID 86587467, compound

Product 1

HCID 20816860HCID 20816860, compound

Sources & evidence

ORD record
ord-17e5c210d5f64095af2ec15f7df8fc2f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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