5-chloro-2-[2-(5-chloro-2,4-dimethoxy-phenyl)ethyl]-2-cyclopentyl-4-hydroxy-3H-pyran-6-one → HCID 178489976, compound
Reaction equation
[CH3:9][c:10]1[cH:11][c:12]([CH3:13])[n:14]2[n:15][c:16]([SH:17])[n:18][c:19]2[n:20]1.[Cl:21][C:22]1=[C:27]([OH:28])[CH2:26][C:25]([CH:29]2[CH2:30][CH2:31][CH2:32][CH2:33]2)([CH2:34][CH2:35][c:36]2[cH:37][cH:38][c:39]([O:42][CH3:43])[cH:40][cH:41]2)[O:24][C:23]1=[O:44].[Cl:45][C:46]1=[C:70]([OH:71])[CH2:69][C:50]([CH2:51][CH2:52][c:53]2[cH:54][c:55]([Cl:56])[c:57]([O:58][CH3:59])[cH:60][c:61]2[O:62][CH3:63])([CH:64]2[CH2:65][CH2:66][CH2:67][CH2:68]2)[O:49][C:47]1=[O:48].[OH:1][c:2]1[n:3]([CH3:8])[c:4]([SH:7])[n:5][n:6]1>>[OH:1][c:2]1[n:3]([CH3:8])[c:4]([S:7][C:22]2=[C:27]([OH:28])[CH2:26][C:25]([CH:29]3[CH2:30][CH2:31][CH2:32][CH2:33]3)([CH2:34][CH2:35][c:36]3[cH:37][cH:38][c:39]([O:42][CH3:43])[cH:40][cH:41]3)[O:24][C:23]2=[O:44])[n:5][n:6]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-d00f7864c3d44240af08111e43f36b69
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…