Hydrochloric Acid → Hydrochloric Acid

HRID 152490Notes

Reaction equation

HRID 152490 reaction equation
[CH3:34][CH2:35][OH:36].[ClH:33].[Li+:1].[O:3]=[C:4]1[NH:5][c:6]2[n:7][cH:8][cH:9][cH:10][c:11]2[C:12]12[CH2:13][c:14]1[cH:15][cH:16][c:17]([NH:21][c:22]3[cH:23][c:24]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[n:25][cH:26][n:27]3)[cH:18][c:19]1[CH2:20]2.[OH-:2]>>[ClH:33].[O:3]=[C:4]1[NH:5][c:6]2[n:7][cH:8][cH:9][cH:10][c:11]2[C:12]12[CH2:13][c:14]1[cH:15][cH:16][c:17]([NH:21][c:22]3[cH:23][c:24]([C:28](=[O:29])[OH:30])[n:25][cH:26][n:27]3)[cH:18][c:19]1[CH2:20]2

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 961HydroxideHCID 28486Lithium ionHCID 58117511Ethyl 6-(2'-oxo-1,1',2',3-tetrahydrospiro[indene-2,3'-pyrrolo[2,3-b]pyridin]-5-ylamino)pyrimidine-4-carboxylate

Product 2

HCID 313Hydrochloric AcidHCID 581174936-[(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)amino]pyrimidine-4-carboxylic acid

Sources & evidence

ORD record
ord-3ab71864b4fa486da325aa5a7c51fe23
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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