Calcium Cation → HCID 4979943, compound

HRID 183429Notes

Reaction equation

HRID 183429 reaction equation
[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[CH3:6])[c:7]1[n:8][c:9]([CH:30]([CH3:31])[CH3:32])[c:10]([CH:20]=[CH:21][CH:22]2[CH2:23][CH:24]([OH:29])[CH2:25][C:26](=[O:28])[O:27]2)[c:11](-[c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[n:12]1.[Ca+2:34].[OH-:33].[OH-:35].[OH2:36]>>[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[CH3:6])[c:7]1[n:8][c:9]([CH:30]([CH3:31])[CH3:32])[c:10]([CH:20]=[CH:21][CH:22]([CH2:23][CH:24]([CH2:25][C:26]([OH:28])=[O:33])[OH:29])[OH:27])[c:11](-[c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[n:12]1

Participants

5

Reactant 4

HCID 271Calcium CationHCID 961Hydroxide2×HCID 962WaterHCID 53395141HCID 53395141, compound

Product 1

HCID 4979943HCID 4979943, compound

Sources & evidence

ORD record
ord-a90f85f961b34947bd8a120598ee1d53
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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