Water → HCID 21539606, compound

HRID 2339582Notes

Reaction equation

HRID 2339582 reaction equation
[CH3:13][C:14]([CH2:15][OH:16])([CH3:17])[O:18][c:19]1[cH:20][cH:21][c:22](-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:23][cH:24]1.[Cl:1][N:2]1[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1.[Fe+2:43].[OH2:31].[OH2:32].[OH2:33].[OH2:34].[OH2:35].[OH2:36].[OH2:37].[OH2:44].[S:38]([O-:39])([O-:40])(=[O:41])=[O:42].[S:8](=[O:9])(=[O:10])([OH:11])[OH:12]>>[N:2]1([c:28]2[cH:27][cH:26][c:25](-[c:22]3[cH:21][cH:20][c:19]([O:18][C:14]([CH3:13])([CH2:15][OH:16])[CH3:17])[cH:24][cH:23]3)[cH:30][cH:29]2)[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1

Participants

7

Sources & evidence

ORD record
ord-ffc3e59f18dd4749ad548fb909550f39
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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