Sodium ion → HCID 59464124, compound

HRID 177618Notes

Reaction equation

HRID 177618 reaction equation
[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[Cl:2][c:3]1[c:4]([NH:19][C:20]([O:21][CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)=[O:29])[cH:5][cH:6][c:7]([CH:9]2[CH2:10][CH2:11][C:12]3([O:13][CH2:16][CH2:15][O:14]3)[CH2:17][CH2:18]2)[cH:8]1.[F:38][C:39]([F:40])([F:41])[C:42]([OH:43])=[O:44].[Na+:31].[OH-:30].[OH2:1]>>[Cl:2][c:3]1[c:4]([NH:19][C:20]([O:21][CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)=[O:29])[cH:5][cH:6][c:7]([CH:9]2[CH2:10][CH2:11][C:12](=[O:13])[CH2:17][CH2:18]2)[cH:8]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 59464262HCID 59464262, compound

Product 1

HCID 59464124HCID 59464124, compound

Sources & evidence

ORD record
ord-9e58c29b8cac4d4d93be47cd527baaac
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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