Methanol → HCID 45256866, compound

HRID 2346545Notes

Reaction equation

HRID 2346545 reaction equation
[CH2:3][CH3:4].[CH3:42][OH:43].[F:5][c:6]1[c:7](-[c:27]2[cH:28][cH:29][c:30](-[c:33]3[cH:34][cH:35][c:36]([C:39](=[O:40])[O-:41])[cH:37][cH:38]3)[cH:31][cH:32]2)[cH:8][c:9]2[c:10]([nH:11][c:12]([O:14][c:15]3[cH:16][c:17]([C:22](=[O:23])[O:24][CH3:25])[c:18]([CH3:21])[cH:19][cH:20]3)[n:13]2)[cH:26]1.[Na+:2].[OH-:1].[OH2:44]>>[F:5][c:6]1[c:7](-[c:27]2[cH:28][cH:29][c:30](-[c:33]3[cH:34][cH:35][c:36]([C:39](=[O:40])[OH:41])[cH:37][cH:38]3)[cH:31][cH:32]2)[cH:8][c:9]2[c:10]([nH:11][c:12]([O:14][c:15]3[cH:16][c:17]([C:22](=[O:23])[OH:24])[c:18]([CH3:21])[cH:19][cH:20]3)[n:13]2)[cH:26]1

Participants

7

Reactant 6

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 123138EthylHCID 86640505HCID 86640505, compound

Product 1

HCID 45256866HCID 45256866, compound

Sources & evidence

ORD record
ord-69399b57af54449b9ee84a5d5275cefc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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