Water → HCID 46896468, 화합물

HRID 2123149

반응식

HRID 2123149 반응식
[CH3:1][S:2](=[O:3])[c:4]1[n:5][cH:6][cH:7][c:8](-[c:10]2[cH:11][n:12][c:13]3[n:14]2[cH:15][cH:16][cH:17][c:18]3[C:19]([CH3:20])([CH3:21])[OH:22])[n:9]1.[CH3:23][S:24](=[O:25])(=[O:26])[CH:27]1[CH2:28][CH2:29][CH:30]([NH:33][CH3:34])[CH2:31][CH2:32]1.[CH3:35][N:36]1[CH2:37][CH2:38][CH2:39][C:40]1=[O:41].[OH2:42]>>[c:4]1([N:33]([CH:30]2[CH2:29][CH2:28][CH:27]([S:24]([CH3:23])(=[O:25])=[O:26])[CH2:32][CH2:31]2)[CH3:34])[n:5][cH:6][cH:7][c:8](-[c:10]2[cH:11][n:12][c:13]3[n:14]2[cH:15][cH:16][cH:17][c:18]3[C:19]([CH3:20])([CH3:21])[OH:22])[n:9]1

참가 물질

5

출처 및 근거

ORD 기록
ord-af97a901385d40bc9583a0b10f44efaa
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

불러오는 중…