Acetic Acid → HCID 150640, compound

HRID 1560238Notes

Reaction equation

HRID 1560238 reaction equation
[CH3:43][C:44](=[O:45])[OH:46].[N:7]([O-:8])=[O:9].[NH2:11][c:12]1[c:13]2[c:14]([Cl:36])[cH:15][c:16]([C:33](=[O:34])[OH:35])[n:17][c:18]2[c:19]([CH2:30][CH2:31][CH3:32])[c:20]2[c:21]1[c:22](=[O:29])[cH:23][c:24]([C:26](=[O:27])[OH:28])[o:25]2.[Na+:10].[OH2:42].[P:1]([P:2]([OH:3])[OH:4])([OH:5])[OH:6].[S:37](=[O:38])(=[O:39])([OH:40])[OH:41]>>[cH:12]1[c:13]2[c:14]([Cl:36])[cH:15][c:16]([C:33](=[O:34])[OH:35])[n:17][c:18]2[c:19]([CH2:30][CH2:31][CH3:32])[c:20]2[c:21]1[c:22](=[O:29])[cH:23][c:24]([C:26](=[O:27])[OH:28])[o:25]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 1118Sulfuric AcidHCID 204784425-amino-6-chloro-4-oxo-10-propyl-4H-pyrano[3,2-g]quinoline-2,8-dicarboxylic acidHCID 22358456Dihydroxyphosphanylphosphonous acid

Product 1

HCID 150640HCID 150640, compound

Sources & evidence

ORD record
ord-467c93fa7a1b4f7aa07ab763565c9975
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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