Chloride → HCID 21015937, compound

HRID 662699Notes

Reaction equation

HRID 662699 reaction equation
[C:39]([O:40][CH3:41])([CH3:42])([CH3:43])[CH3:44].[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6](=[O:7])[O:8][C:9]([CH3:10])([CH3:11])[CH3:12])[CH2:13][S:14][c:15]1[c:16]([NH2:27])[cH:17][c:18]([C:21](=[O:22])[O:23][CH2:24][CH:25]=[CH2:26])[cH:19][cH:20]1)=[O:28].[Cl-:46].[Na+:34].[Na+:35].[Na+:36].[Na+:38].[Na+:45].[OH-:37].[P:29]([O-:30])([O-:31])([O-:32])=[O:33]>>[O:2]=[C:3]([CH:4]([NH:5][C:6](=[O:7])[O:8][C:9]([CH3:10])([CH3:11])[CH3:12])[CH2:13][S:14][c:15]1[c:16]([NH2:27])[cH:17][c:18]([C:21](=[O:22])[O:23][CH2:24][CH:25]=[CH2:26])[cH:19][cH:20]1)[OH:28]

Participants

7

Reactant 6

HCID 312ChlorideHCID 923Sodium ion5×HCID 961HydroxideHCID 1061PhosphateHCID 15413tert-Butyl methyl etherHCID 21015943HCID 21015943, compound

Product 1

HCID 21015937HCID 21015937, compound

Sources & evidence

ORD record
ord-633554d715f341dfb728402e123feb71
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…