Acetic Acid → HCID 69287240, compound

HRID 1147374Notes

Reaction equation

HRID 1147374 reaction equation
[CH3:1][C:2](=[O:3])[OH:4].[CH3:29][CH2:30][OH:31].[CH3:32][CH2:33][O:34][C:35]([CH3:36])=[O:37].[c:5]1([CH:11]([CH3:12])[NH:13][C:14]2=[C:15]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[CH2:16][C:17]3([O:18][CH2:19][CH2:20][O:21]3)[CH2:22][CH2:23]2)[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[c:5]1([CH:11]([CH3:12])[NH:13][CH:14]2[CH:15]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[CH2:16][C:17]3([O:18][CH2:19][CH2:20][O:21]3)[CH2:22][CH2:23]2)[cH:6][cH:7][cH:8][cH:9][cH:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 702EthanolHCID 8857Ethyl AcetateHCID 68765641HCID 68765641, compound

Product 1

HCID 69287240HCID 69287240, compound

Sources & evidence

ORD record
ord-a37688fb89dd4a68936f9d4134fe43e4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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