Methanol → 5-Propyl-azepane-2-carboxylic acid [2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyl-tetrahydro-pyran-2-yl)-propyl]-amide

反応式

[CH3:29][OH:30].[Cl:1][CH:2]([CH:3]([CH:4]1[O:5][CH:6]([S:13][CH3:14])[CH:7]([OH:12])[CH:8]([OH:11])[CH:9]1[OH:10])[NH:15][C:16](=[O:17])[CH:18]1[NH:19][CH2:20][CH2:21][C:22]([CH2:25][CH2:26][CH3:27])=[CH:23][CH2:24]1)[CH3:28]>>[Cl:1][CH:2]([CH:3]([CH:4]1[O:5][CH:6]([S:13][CH3:14])[CH:7]([OH:12])[CH:8]([OH:11])[CH:9]1[OH:10])[NH:15][C:16](=[O:17])[CH:18]1[NH:19][CH2:20][CH2:21][CH:22]([CH2:25][CH2:26][CH3:27])[CH2:23][CH2:24]1)[CH3:28]

参加物

反応物 2

HCID 887Methanol

HCID 724404095-Propyl-2,3,6,7-tetrahydro-1H-azepine-2-carboxylic acid [2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyl-tetrahydro-pyran-2-yl)-propyl]-amide

生成物 1

HCID 730964105-Propyl-azepane-2-carboxylic acid [2-chloro-1-(3,4,5-trihydroxy-6-methylsulfanyl-tetrahydro-pyran-2-yl)-propyl]-amide

出典と根拠

ORDレコード: ord-289adb83dcec446bb51d0794c46dfa9d
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…