Calcium Cation → HCID 54200266, compound

HRID 1239653Notes

Reaction equation

HRID 1239653 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:14]2[S:15][CH:16]([c:19]3[cH:20][c:21]([O:29][CH3:30])[c:22]([O:27][CH3:28])[c:23]([O:25][CH3:26])[cH:24]3)[CH2:17][CH2:18]2)[cH:6][c:7]([N+:11]([O-:12])=[O:13])[c:8]1[O:9][CH3:10].[CH3:34][CH2:35][OH:36].[Ca+2:32].[Cl-:31].[Cl-:33].[OH2:37].[Zn:38]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:14]2[S:15][CH:16]([c:19]3[cH:20][c:21]([O:29][CH3:30])[c:22]([O:27][CH3:28])[c:23]([O:25][CH3:26])[cH:24]3)[CH2:17][CH2:18]2)[cH:6][c:7]([NH2:11])[c:8]1[O:9][CH3:10]

Participants

7

Reactant 6

HCID 271Calcium CationHCID 312Chloride2×HCID 702EthanolHCID 962WaterHCID 23994ZincHCID 54221762HCID 54221762, compound

Product 1

HCID 54200266HCID 54200266, compound

Sources & evidence

ORD record
ord-2b8ba29ab6b54ec7a2a690101f51845f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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