Acetic Acid → HCID 77557598, compound

HRID 1572804Notes

Reaction equation

HRID 1572804 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][N:10]1[CH2:11][CH2:12][CH:13]([C:16]([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)=[O:24])[CH2:14][CH2:15]1)[CH2:25][c:26]1[cH:27][cH:28][c:29]([N+:32]([O-:33])=[O:34])[cH:30][cH:31]1)=[O:35].[CH3:39][C:40](=[O:41])[OH:42].[Ca+2:38].[Cl-:36].[Cl-:37].[Zn:43]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH:8]([CH2:9][N:10]1[CH2:11][CH2:12][CH:13]([C:16]([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)=[O:24])[CH2:14][CH2:15]1)[CH2:25][c:26]1[cH:27][cH:28][c:29]([NH2:32])[cH:30][cH:31]1)=[O:35]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 271Calcium CationHCID 312Chloride2×HCID 23994ZincHCID 77557648HCID 77557648, compound

Product 1

HCID 77557598HCID 77557598, compound

Sources & evidence

ORD record
ord-62ab3448ec654723821f51b5151ddf9b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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