Hydrochloric Acid → 1-[4-[7-(2,3-dihydroxypropyl)-4-(3-methylmorpholin-4-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]phenyl]-3-ethylurea
反応式
[CH3:1][C:2]1([CH3:37])[O:3][CH2:4][CH:5]([CH2:7][N:8]2[CH2:9][c:10]3[n:11][c:12](-[c:25]4[cH:26][cH:27][c:28]([NH:31][C:32](=[O:33])[NH:34][CH2:35][CH3:36])[cH:29][cH:30]4)[n:13][c:14]([N:18]4[CH:19]([CH3:24])[CH2:20][O:21][CH2:22][CH2:23]4)[c:15]3[CH2:16][CH2:17]2)[O:6]1.[ClH:38].[OH2:39]>>[OH:3][CH2:4][CH:5]([OH:6])[CH2:7][N:8]1[CH2:9][c:10]2[n:11][c:12](-[c:25]3[cH:26][cH:27][c:28]([NH:31][C:32](=[O:33])[NH:34][CH2:35][CH3:36])[cH:29][cH:30]3)[n:13][c:14]([N:18]3[CH:19]([CH3:24])[CH2:20][O:21][CH2:22][CH2:23]3)[c:15]2[CH2:16][CH2:17]1参加物
4
反応物 3
生成物 1
出典と根拠
- ORDレコード
- ord-fb5cd1e129e5451291b9a4a9db15db9f
- 出典データセット
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)