Acetic Acid → HCID 136347216, compound

HRID 194203Notes

Reaction equation

HRID 194203 reaction equation
[CH3:38][C:39](=[O:40])[OH:41].[O:1]=[S:2]1(=[O:31])[N:3]=[C:4]([c:12]2[c:13](=[O:30])[n:14]([CH2:23][CH2:24][CH:25]3[O:26][CH2:29][CH2:28][O:27]3)[c:15]3[n:16][cH:17][cH:18][cH:19][c:20]3[c:21]2[OH:22])[NH:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2.[OH2:37].[S:32](=[O:33])(=[O:34])([OH:35])[OH:36]>>[O:1]=[S:2]1(=[O:31])[N:3]=[C:4]([c:12]2[c:13](=[O:30])[n:14]([CH2:23][CH2:24][CH:25]=[O:26])[c:15]3[n:16][cH:17][cH:18][cH:19][c:20]3[c:21]2[OH:22])[NH:5][c:6]2[c:7]1[cH:8][cH:9][cH:10][cH:11]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 1118Sulfuric AcidHCID 136373917HCID 136373917, compound

Product 1

HCID 136347216HCID 136347216, compound

Sources & evidence

ORD record
ord-e5471069c54a4acf8769cec4718e807b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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