Acetic Acid → HCID 23728855, compound

HRID 116004Notes

Reaction equation

HRID 116004 reaction equation
[CH2:21]1[CH2:22][O:23][CH2:24][CH2:25][NH:26]1.[CH2:33]1[O:34][CH2:35][CH2:36][CH2:37]1.[CH3:27][C:28](=[O:29])[OH:30].[CH3:31][OH:32].[CH:1]1([N:4]2[CH2:5][CH2:6][N:7]([c:10]3[s:11][c:12]4[c:13]([n:14]3)[cH:15][cH:16][c:17]([CH:19]=[O:20])[cH:18]4)[CH2:8][CH2:9]2)[CH2:2][CH2:3]1>>[CH:1]1([N:4]2[CH2:5][CH2:6][N:7]([c:10]3[s:11][c:12]4[c:13]([n:14]3)[cH:15][cH:16][c:17]([CH2:19][N:26]3[CH2:21][CH2:22][O:23][CH2:24][CH2:25]3)[cH:18]4)[CH2:8][CH2:9]2)[CH2:2][CH2:3]1

Participants

6

Sources & evidence

ORD record
ord-38c3d61987834c76be557b12a596dcdd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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