Acetic Acid → HCID 59620410, compound

HRID 321703Notes

Reaction equation

HRID 321703 reaction equation
[CH3:39][C:40](=[O:41])[OH:42].[CH3:5][C:6]([O:7][C:8](=[O:9])[CH3:10])=[O:11].[CH:32]([O:33][CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[O:17]=[C:18]1[NH:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]2[CH2:26][CH:27]1[NH:28][C:29]([CH3:30])=[O:31].[OH:1][N+:2]([O-:3])=[O:4].[S:12](=[O:13])(=[O:14])([OH:15])[OH:16]>>[O-:1][N+:2](=[O:4])[c:21]1[c:20]2[c:25]([cH:24][cH:23][cH:22]1)[CH2:26][CH:27]([NH:28][C:29]([CH3:30])=[O:31])[C:18](=[O:17])[NH:19]2

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 944Nitric AcidHCID 1118Sulfuric AcidHCID 7914Diisopropyl EtherHCID 7918Acetic AnhydrideHCID 44521548HCID 44521548, compound

Product 1

HCID 59620410HCID 59620410, compound

Sources & evidence

ORD record
ord-125b3c09980d44a58c82f0572d0bc05d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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