Ethanol → HCID 178443651, compound

HRID 1114123Notes

Reaction equation

HRID 1114123 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:20][CH2:21][CH:22]([CH2:23][NH:24][CH2:25][CH2:26][c:27]2[cH:28][cH:29][c:30]([NH:31][CH:32]3[CH2:33][CH2:34][N:35]([C:38](=[O:39])[NH:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH3:48])[CH2:36][CH2:37]3)[cH:49][cH:50]2)[OH:51])[c:13]2[c:18]1[NH:17][C:16](=[O:19])[CH2:15][CH2:14]2.[CH3:54][CH2:55][OH:56].[H:52][H:53]>>[OH:8][c:9]1[cH:10][cH:11][c:12]([O:20][CH2:21][CH:22]([CH2:23][NH:24][CH2:25][CH2:26][c:27]2[cH:28][cH:29][c:30]([NH:31][CH:32]3[CH2:33][CH2:34][N:35]([C:38](=[O:39])[NH:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH3:48])[CH2:36][CH2:37]3)[cH:49][cH:50]2)[OH:51])[c:13]2[c:18]1[NH:17][C:16](=[O:19])[CH2:15][CH2:14]2

Participants

4

Reactant 3

HCID 702EthanolHCID 178418361HCID 178418361, compoundHCID 178443652HCID 178443652, compound

Product 1

HCID 178443651HCID 178443651, compound

Sources & evidence

ORD record
ord-749305f2fcf8455c813c195835a01ccb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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