Acetic Acid → Calcium

HRID 1222735Notes

Reaction equation

HRID 1222735 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][CH:6]1[CH2:7][N:8]([c:12]2[cH:13][c:14]([F:33])[c:15]([N:19]3[CH2:20][CH2:21][C:22]([CH2:25][O:26][CH3:27])([O:28][P:29]([OH:30])([OH:31])=[O:32])[CH2:23][CH2:24]3)[c:16]([F:18])[cH:17]2)[C:9](=[O:11])[O:10]1.[C:34](=[O:35])([O-:36])[O-:37].[C:38]([OH:39])(=[O:40])[CH3:41].[Ca+2:42]>>[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][CH:6]1[CH2:7][N:8]([c:12]2[cH:13][c:14]([F:33])[c:15]([N:19]3[CH2:20][CH2:21][C:22]([CH2:25][O:26][CH3:27])([O:28][P:29](=[O:30])([OH:31])[OH:32])[CH2:23][CH2:24]3)[c:16]([F:18])[cH:17]2)[C:9](=[O:11])[O:10]1.[Ca:42]

Participants

6

Reactant 4

HCID 176Acetic AcidHCID 271Calcium CationHCID 19660Carbonate IonHCID 74325084HCID 74325084, compound

Product 2

HCID 5460341CalciumHCID 74325084HCID 74325084, compound

Sources & evidence

ORD record
ord-6e7f110a2cd74c3fbc745d4cb808a3ab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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