Calcium Cation → HCID 58158506, compound

HRID 137600Notes

Reaction equation

HRID 137600 reaction equation
[CH3:31][CH2:32][OH:33].[Ca+2:30].[Cl-:28].[Cl-:29].[Fe:34].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([O:10][c:11]2[cH:12][cH:13][c:14]([NH:17][C:18]([O:19][CH2:20][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)=[O:27])[cH:15][cH:16]2)[cH:8][n:9]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([O:10][c:11]2[cH:12][cH:13][c:14]([NH:17][C:18]([O:19][CH2:20][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)=[O:27])[cH:15][cH:16]2)[cH:8][n:9]1

Participants

6

Reactant 5

HCID 271Calcium CationHCID 312Chloride2×HCID 702EthanolHCID 23925IronHCID 58158492HCID 58158492, compound

Product 1

HCID 58158506HCID 58158506, compound

Sources & evidence

ORD record
ord-1fb2a2b678274bc396919d8c9b2adfa6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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