Acetic Acid → HCID 178439541, compound

HRID 2340553Notes

Reaction equation

HRID 2340553 reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:27])[c:6]([CH2:24][CH2:25][CH3:26])[c:7]([CH2:8][S:9][CH2:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[n:18][n:19][n:20][nH:21]3)[cH:15][cH:16]2)[cH:22][cH:23]1.[CH2:34]([Cl:35])[Cl:36].[CH3:30][C:31]([OH:32])=[O:33].[OH:28][OH:29]>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:27])[c:6]([CH2:24][CH2:25][CH3:26])[c:7]([CH2:8][S:9]([CH2:10][c:11]2[cH:12][cH:13][c:14](-[c:17]3[nH:18][n:19][n:20][n:21]3)[cH:15][cH:16]2)=[O:32])[cH:22][cH:23]1

Participants

5

Sources & evidence

ORD record
ord-b7a610e7447f407cb62f34b0ae50abaa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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