Acetic Acid → HCID 10275841, compound

HRID 1204427Notes

Reaction equation

HRID 1204427 reaction equation
[CH2:38]1[O:39][CH2:40][CH2:41][O:42][CH2:43]1.[CH3:44][C:45](=[O:46])[OH:47].[Li+:37].[OH-:36].[OH2:35].[OH2:48].[c:1]1([CH3:34])[cH:2][cH:3][c:4]([N:7]([C:8](=[O:9])[c:10]2[o:11][cH:12][cH:13][cH:14]2)[CH:15]2[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][C:23]3([CH2:29][C:30](=[O:31])[O:32][CH3:33])[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)[CH2:19][CH2:20]2)[cH:5][cH:6]1>>[c:1]1([CH3:34])[cH:2][cH:3][c:4]([N:7]([C:8](=[O:9])[c:10]2[o:11][cH:12][cH:13][cH:14]2)[CH:15]2[CH2:16][CH2:17][N:18]([CH2:21][CH2:22][C:23]3([CH2:29][C:30](=[O:31])[OH:32])[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)[CH2:19][CH2:20]2)[cH:5][cH:6]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 961HydroxideHCID 962Water2×HCID 28486Lithium ionHCID 312751,4-DioxaneHCID 10115897HCID 10115897, compound

Product 1

HCID 10275841HCID 10275841, compound

Sources & evidence

ORD record
ord-25857827b61b491ea1ef74bfa5e4637b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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