Ethanol → HCID 178511397, compound

HRID 1219983Notes

Reaction equation

HRID 1219983 reaction equation
[CH2:44]([OH:45])[CH3:46].[NH2:42][NH2:43].[OH2:40].[OH2:41].[nH:1]1[cH:2][c:3]([CH2:10][CH:11]([CH2:12][O:13][c:14]2[s:15][c:16](-[c:19]3[cH:20][c:21]4[cH:22][cH:23][n:24][cH:25][c:26]4[cH:27][cH:28]3)[n:17][n:18]2)[N:29]2[C:30](=[O:31])[c:32]3[c:33]([cH:34][cH:35][cH:36][cH:37]3)[C:38]2=[O:39])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[cH:2][c:3]([CH2:10][CH:11]([CH2:12][O:13][c:14]2[s:15][c:16](-[c:19]3[cH:20][c:21]4[cH:22][cH:23][n:24][cH:25][c:26]4[cH:27][cH:28]3)[n:17][n:18]2)[NH2:29])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12

Participants

5

Sources & evidence

ORD record
ord-73e16faa3422477f9f990f1ef14caaf7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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