Acetic Acid → HCID 19938413, compound

HRID 2142447Notes

Reaction equation

HRID 2142447 reaction equation
[C:1](=[O:2])([CH3:3])[S:4][CH2:5][CH:6]([C:7](=[O:8])[NH:9][CH:10]([CH2:11][C:12](=[O:13])[OH:14])[CH2:15][CH:16]([CH3:17])[CH3:18])[C:19]([F:20])([F:21])[F:22].[CH3:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30].[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[CH3:38][OH:39].[CH3:40][C:41](=[O:42])[OH:43].[NH4+:23].[OH-:24].[OH2:37]>>[SH:4][CH2:5][CH:6]([C:7](=[O:8])[NH:9][CH:10]([CH2:11][C:12](=[O:13])[OH:14])[CH2:15][CH:16]([CH3:17])[CH3:18])[C:19]([F:20])([F:21])[F:22]

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 223AmmoniumHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 8058HexaneHCID 8857Ethyl AcetateHCID 19938460HCID 19938460, compound

Product 1

HCID 19938413HCID 19938413, compound

Sources & evidence

ORD record
ord-e00b51e1ece444baa01bc4465b0136c1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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