Acetic Acid → HCID 178507933, compound

HRID 320653Notes

Reaction equation

HRID 320653 reaction equation
[C:42]([OH:43])(=[O:44])[CH3:45].[CH3:46][OH:47].[CH:25]1([O:30][C:31]([CH:32]([NH2:33])[CH2:34][c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)=[O:41])[CH2:26][CH2:27][CH2:28][CH2:29]1.[NH2:1][c:2]1[c:3]([C:16]([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)=[O:24])[cH:4][cH:5][c:6](=[O:15])[n:7]1[CH:8]1[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1>>[NH2:1][c:2]1[c:3]([C:16]([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)=[O:24])[cH:4][cH:5][c:6](=[O:15])[n:7]1[CH:8]1[CH2:9][CH2:10][CH:11]([NH:33][CH:32]([C:31]([O:30][CH:25]2[CH2:26][CH2:27][CH2:28][CH2:29]2)=[O:41])[CH2:34][c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[CH2:12][CH2:13]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 22671095Cyclopentyl 2-amino-3-phenylpropanoateHCID 576584256-Amino-5-(4-fluorobenzoyl)-1-(4-oxo-cyclohexyl)-1H-pyridin-2-one

Product 1

HCID 178507933HCID 178507933, compound

Sources & evidence

ORD record
ord-d298920966ad4a0dbca59854ea07e0b9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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