Hydrochloric Acid → Ethyl 10-amino-3-hydroxy-4-oxo-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxylate

Reaction equation

[CH2:1]([O:2][C:3](=[O:4])[NH:11][C:12]12[c:13]3[n:14]([c:21](=[O:31])[c:22]([OH:30])[c:23]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[n:24]3)[CH2:15][CH:16]([CH2:17][CH2:18]1)[CH2:19][CH2:20]2)[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH3:35][CH2:36][OH:37].[ClH:32].[H:33][H:34]>>[NH2:11][C:12]12[c:13]3[n:14]([c:21](=[O:31])[c:22]([OH:30])[c:23]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[n:24]3)[CH2:15][CH:16]([CH2:17][CH2:18]1)[CH2:19][CH2:20]2

Participants

Reactant 4

HCID 313Hydrochloric Acid

HCID 702Ethanol

HCID 57904801Ethyl 10-(((benzyloxy)carbonyl)amino)-3-hydroxy-4-oxo-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxylate

HCID 178418361HCID 178418361, compound

Product 1

HCID 57905130Ethyl 10-amino-3-hydroxy-4-oxo-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxylate

Sources & evidence

ORD record: ord-d9e4f512e11844ff8f010828a832b4b0
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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