Methanol → HCID 178450058, compound

HRID 1544778Notes

Reaction equation

HRID 1544778 reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH2:5][CH2:6][CH2:7][S:8](=[O:9])(=[O:10])[NH:11][C:12](=[O:13])[c:14]1[c:15]([O:46][CH2:47][CH:48]([CH3:49])[CH3:50])[cH:16][c:17](-[c:20]2[cH:21][cH:22][c:23]([CH2:26][CH2:27][CH2:28][N:29]([CH2:30][CH:31]([c:32]3[cH:33][n:34][cH:35][cH:36][cH:37]3)[OH:38])[C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[cH:24][cH:25]2)[cH:18][cH:19]1.[CH3:53][OH:54].[Na+:52].[O:55]1[CH2:56][CH2:57][CH2:58][CH2:59]1.[OH-:51]>>[OH:4][CH2:5][CH2:6][CH2:7][S:8](=[O:9])(=[O:10])[NH:11][C:12](=[O:13])[c:14]1[c:15]([O:46][CH2:47][CH:48]([CH3:49])[CH3:50])[cH:16][c:17](-[c:20]2[cH:21][cH:22][c:23]([CH2:26][CH2:27][CH2:28][N:29]([CH2:30][CH:31]([c:32]3[cH:33][n:34][cH:35][cH:36][cH:37]3)[OH:38])[C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[cH:24][cH:25]2)[cH:18][cH:19]1

Participants

6

Reactant 5

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 178476329HCID 178476329, compound

Product 1

HCID 178450058HCID 178450058, compound

Sources & evidence

ORD record
ord-edd6286c4bad461094f7d37612149d20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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