Acetic Acid → HCID 59375547, compound

HRID 205977Notes

Reaction equation

HRID 205977 reaction equation
[C:31](=[O:32])([O-:33])[OH:34].[CH3:1][CH:2]([C:3]([CH3:4])([CH3:5])[CH3:6])[NH:7][c:8]1[n:9][c:10]2[cH:11][cH:12][nH:13][c:14](=[O:22])[c:15]2[c:16]2[c:17]1[cH:18][cH:19][n:20][cH:21]2.[CH3:48][C:49](=[O:50])[OH:51].[Na+:35].[Na+:46].[Na+:47].[O:23]=[C:24]1[N:25]([I:30])[C:26](=[O:27])[CH2:28][CH2:29]1.[OH2:36].[OH2:37].[OH2:38].[OH2:39].[OH2:40].[S:41]([O-:42])([O-:43])(=[O:44])=[S:45]>>[CH3:1][CH:2]([C:3]([CH3:4])([CH3:5])[CH3:6])[NH:7][c:8]1[n:9][c:10]2[c:11]([I:30])[cH:12][nH:13][c:14](=[O:22])[c:15]2[c:16]2[c:17]1[cH:18][cH:19][n:20][cH:21]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ion3×HCID 962Water5×HCID 1084Thiosulfate ionHCID 120273N-IodosuccinimideHCID 25098356HCID 25098356, compound

Product 1

HCID 59375547HCID 59375547, compound

Sources & evidence

ORD record
ord-7285c0ce621c401f8d29944247b9e114
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…