3-[4-(1-Amino-cyclobutyl)-phenyl]-2-phenyl-7H-pyrano[2,3-e]indazol-4-one → 7-Amino-3-[4-(1-amino-cyclobutyl)-phenyl]-8-hydroxy-2-phenyl-chromen-4-one

HRID 1229999Notes

Reaction equation

HRID 1229999 reaction equation
[C:32]([O:33][C:34](=[O:35])[NH:38][C:39]1([c:43]2[cH:44][cH:45][c:46](-[c:49]3[c:50](-[c:62]4[cH:63][cH:64][cH:65][cH:66][cH:67]4)[o:51][c:52]4[c:53]([OH:61])[c:54]([NH2:60])[cH:55][cH:56][c:57]4[c:58]3=[O:59])[cH:47][cH:48]2)[CH2:40][CH2:41][CH2:42]1)([CH3:36])([CH3:37])[CH3:68].[NH2:1][C:2]1([c:3]2[cH:4][cH:5][c:6](-[c:7]3[c:8](=[O:9])[c:10]4[c:11]([o:12][c:13]3-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[c:20]3[c:21]([cH:22][cH:23]4)[nH:24][n:25][cH:26]3)[cH:27][cH:28]2)[CH2:29][CH2:30][CH2:31]1>>[NH2:38][C:39]1([c:43]2[cH:44][cH:45][c:46](-[c:49]3[c:50](-[c:62]4[cH:63][cH:64][cH:65][cH:66][cH:67]4)[o:51][c:52]4[c:53]([OH:61])[c:54]([NH2:60])[cH:55][cH:56][c:57]4[c:58]3=[O:59])[cH:47][cH:48]2)[CH2:40][CH2:41][CH2:42]1

Participants

3

Reactant 2

HCID 510295913-[4-(1-Amino-cyclobutyl)-phenyl]-2-phenyl-7H-pyrano[2,3-e]indazol-4-oneHCID 67067987{1-[4-(7-Amino-8-hydroxy-4-oxo-2-phenyl-4H-chromen-3-yl)-phenyl]-cyclobutyl}-carbamic acid tert-butyl ester

Product 1

HCID 510305147-Amino-3-[4-(1-amino-cyclobutyl)-phenyl]-8-hydroxy-2-phenyl-chromen-4-one

Sources & evidence

ORD record
ord-b0d75725d8b242df9f643bdf9ae0f41e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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