Sodium ion → HCID 17965904, compound

HRID 205399Notes

Reaction equation

HRID 205399 reaction equation
[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[Cl:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[cH:7][c:8]([C:9](=[O:10])[NH:11][c:12]3[s:13][c:14]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:15][n:16]3)[cH:22][c:23]([O:25][CH2:26][c:27]3[c:28]([Cl:33])[cH:29][cH:30][cH:31][cH:32]3)[cH:24]2)[cH:34][cH:35][cH:36][cH:37]1.[Na+:39].[OH-:38].[OH2:45]>>[Cl:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[cH:7][c:8]([C:9](=[O:10])[NH:11][c:12]3[s:13][c:14]([C:17](=[O:18])[OH:19])[cH:15][n:16]3)[cH:22][c:23]([O:25][CH2:26][c:27]3[c:28]([Cl:33])[cH:29][cH:30][cH:31][cH:32]3)[cH:24]2)[cH:34][cH:35][cH:36][cH:37]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 59735873HCID 59735873, compound

Product 1

HCID 17965904HCID 17965904, compound

Sources & evidence

ORD record
ord-87a9090f5cf24ffb8d7912bc5ab3f3f6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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