Ethanol → HCID 178445361, compound

HRID 2157082Notes

Reaction equation

[CH3:41][CH2:42][OH:43].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[O:1]1[CH:2]([O:7][NH:8][C:9](=[O:10])[CH:11]([CH2:12][CH:13]=[CH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH:21]([C:22](=[O:23])[NH:24][N:25]([CH2:26][CH:27]([CH3:28])[CH3:29])[C:30]([CH2:31][CH2:32][C:33]([CH3:34])=[O:35])=[O:36])[CH2:37][CH:38]([CH3:39])[CH3:40])[CH2:3][CH2:4][CH2:5][CH2:6]1>>[O:1]1[CH:2]([O:7][NH:8][C:9](=[O:10])[CH:11]([CH2:12][CH:13]=[CH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH:21]([C:22](=[O:23])[NH:24][N:25]([CH2:26][CH:27]([CH3:28])[CH3:29])[C:30]([CH2:31][CH2:32][CH:33]([CH3:34])[OH:35])=[O:36])[CH2:37][CH:38]([CH3:39])[CH3:40])[CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

Reactant 3

HCID 702Ethanol

HCID 8857Ethyl Acetate

HCID 1784678585-methyl-3-[[2-methylpropyl(4-oxopentanoyl)amino]carbamoyl]-N-(oxan-2-yloxy)-2-(3-phenylprop-2-enyl)hexanamide

Product 1

HCID 178445361HCID 178445361, compound

Sources & evidence

ORD record: ord-aa3635c64ecf4756bd06fa19a0f9806d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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