Acetic Acid → 3-Amino-6-{1-(tert-butoxycarbonyl)-5-[4-(2-hydroxyethyl)piperazin-1-ylmethyl]indol-2-yl}phthalimide
Reaction equation
[C:44]([O:45][BH-:46]([O:47][C:48](=[O:49])[CH3:50])[O:51][C:52](=[O:53])[CH3:54])(=[O:55])[CH3:56].[CH3:40][C:41](=[O:42])[OH:43].[CH3:64][C:65]#[N:66].[NH2:1][c:2]1[c:3]2[c:4]([c:10](-[c:13]3[n:14]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[c:15]4[cH:16][cH:17][c:18]([CH:22]=[O:23])[cH:19][c:20]4[cH:21]3)[cH:11][cH:12]1)[C:5](=[O:6])[NH:7][C:8]2=[O:9].[Na+:57].[Na+:58].[Na+:59].[O-:60][C:61](=[O:62])[O-:63].[OH2:67].[OH:31][CH2:32][CH2:33][N:34]1[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]1>>[NH2:1][c:2]1[c:3]2[c:4]([c:10](-[c:13]3[n:14]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[c:15]4[cH:16][cH:17][c:18]([CH2:22][N:37]5[CH2:36][CH2:35][N:34]([CH2:33][CH2:32][OH:31])[CH2:39][CH2:38]5)[cH:19][c:20]4[cH:21]3)[cH:11][cH:12]1)[C:5](=[O:6])[NH:7][C:8]2=[O:9]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-aea1374e0a8d4180822660bc95e6bc18
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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