Acetic Acid → HCID 22612086, compound

HRID 2142100Notes

Reaction equation

HRID 2142100 reaction equation
[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[OH:1][C:2]([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][CH:8]([CH2:11][NH:12][C:13]([c:14]2[c:15]([O:20][c:21]3[cH:22][c:23]([C:27]4([CH3:32])[O:28][CH2:31][CH2:30][O:29]4)[cH:24][cH:25][cH:26]3)[n:16][cH:17][cH:18][cH:19]2)=[O:33])[CH2:9][CH2:10]1>>[OH:1][C:2]([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][CH:8]([CH2:11][NH:12][C:13]([c:14]2[c:15]([O:20][c:21]3[cH:22][c:23]([C:27](=[O:28])[CH3:32])[cH:24][cH:25][cH:26]3)[n:16][cH:17][cH:18][cH:19]2)=[O:33])[CH2:9][CH2:10]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 8857Ethyl AcetateHCID 22612367HCID 22612367, compound

Product 1

HCID 22612086HCID 22612086, compound

Sources & evidence

ORD record
ord-86a806aba27f4d0bbecbb51801fcacf1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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