Acetic Acid → HCID 12883909, compound

HRID 2340869Notes

Reaction equation

HRID 2340869 reaction equation
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[n:11][cH:12][c:13]3[c:14]([n:15]2)[nH:16][cH:17][c:18]([C:21](=[O:22])[OH:23])[c:19]3=[O:20])[CH2:8][CH2:9]1.[CH3:33][C:34](=[O:35])[OH:36].[Na+:37].[Na+:38].[O-:39][C:40](=[O:41])[O-:42].[S:24]([O:25][CH2:26][CH3:27])([O:30][CH2:28][CH3:29])(=[O:31])=[O:32]>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[n:11][cH:12][c:13]3[c:14]([n:15]2)[n:16]([CH2:28][CH3:29])[cH:17][c:18]([C:21](=[O:22])[OH:23])[c:19]3=[O:20])[CH2:8][CH2:9]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ion2×HCID 6163Diethyl SulfateHCID 19660Carbonate IonHCID 128507552-(4-Acetyl-1-piperazinyl)-5,8-dihydro-5-oxopyrido[2,3-d]pyrimidine-6-carboxylic acid

Product 1

HCID 12883909HCID 12883909, compound

Sources & evidence

ORD record
ord-ae7a4851a0d543e89fabf3f89c6531bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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