Benzaldehyde, 3-(2-hydroxyethoxy)- → 2-(3-((3-(Isoquinolin-5-ylamino)pyrrolidin-1-yl)methyl)phenoxy)ethanol

반응식

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

참가 물질

반응물 2

HCID 6453965Benzaldehyde, 3-(2-hydroxyethoxy)-

HCID 57936477N-(Pyrrolidin-3-yl)isoquinolin-5-amine

생성물 1

HCID 250083272-(3-((3-(Isoquinolin-5-ylamino)pyrrolidin-1-yl)methyl)phenoxy)ethanol

출처 및 근거

ORD 기록: ord-9b25696ca0fa442da941c68bc4bc8f65
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…