Calcium Cation → Calcium Cation

HRID 1150475Notes

Reaction equation

HRID 1150475 reaction equation
[C:30](=[O:31])([O-:32])[O-:33].[Ca+2:34].[Cl:1][c:2]1[n:3][cH:4][n:5](-[c:16]2[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[NH:25][P:26]([OH:27])([OH:28])=[O:29])[cH:20][cH:21]2)[c:6]1-[c:7]1[cH:8][c:9]([F:15])[c:10]([O:13][CH3:14])[cH:11][cH:12]1.[OH2:35]>>[Ca+2:34].[Cl:1][c:2]1[n:3][cH:4][n:5](-[c:16]2[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[NH:25][P:26](=[O:27])([O-:28])[O-:29])[cH:20][cH:21]2)[c:6]1-[c:7]1[cH:8][c:9]([F:15])[c:10]([O:13][CH3:14])[cH:11][cH:12]1

Participants

6

Reactant 4

HCID 271Calcium CationHCID 962WaterHCID 19660Carbonate IonHCID 9890518HCID 9890518, compound

Product 2

HCID 271Calcium CationHCID 178488639HCID 178488639, compound

Sources & evidence

ORD record
ord-6bf5d6e049224714b269eba02fcbff30
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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