Hydrochloric Acid → Hydrochloric Acid

HRID 2130643Notes

Reaction equation

HRID 2130643 reaction equation
[CH2:3]([CH3:4])[O:5][C:6]([C:7]([NH:8][C:9]([c:10]1[cH:11][c:12]([C:16]2=[N:17][C:18]([CH3:33])([CH3:34])[CH2:19][c:20]3[cH:21][c:22]([O:31][CH3:32])[c:23]4[c:24]([c:25]32)[CH2:26][C:27]([CH3:29])([CH3:30])[O:28]4)[cH:13][cH:14][cH:15]1)=[O:35])([CH3:36])[CH3:37])=[O:38].[CH3:40][CH2:41][OH:42].[ClH:39].[Na+:2].[OH-:1]>>[ClH:39].[O:5]=[C:6]([C:7]([NH:8][C:9]([c:10]1[cH:11][c:12]([C:16]2=[N:17][C:18]([CH3:33])([CH3:34])[CH2:19][c:20]3[cH:21][c:22]([O:31][CH3:32])[c:23]4[c:24]([c:25]32)[CH2:26][C:27]([CH3:29])([CH3:30])[O:28]4)[cH:13][cH:14][cH:15]1)=[O:35])([CH3:36])[CH3:37])[OH:38]

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 223438332-Methyl-N-[3-(3,4,8,9-tetrahydro-6-methoxy-3,3,8,8-tetramethylfuro[2,3-h]isoquinolin-1-yl)benzoyl]alanine ethyl ester

Product 2

HCID 313Hydrochloric AcidHCID 223438292-[[3-(6-Methoxy-3,3,8,8-tetramethyl-4,9-dihydrofuro[2,3-h]isoquinolin-1-yl)benzoyl]amino]-2-methylpropanoic acid

Sources & evidence

ORD record
ord-e7f57c2ee5514f0bb94c5e635e07fbf5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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