Water → Methyl 2-chlorodibenzo[b,f]oxepin-11-carboxylate

HRID 202218

반응식

HRID 202218 반응식
[CH3:32][O:33][C:34]([CH3:35])([CH3:36])[CH3:37].[Cl:11][c:12]1[cH:13][cH:14][c:15]([O:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:16]([C:18]([C:19](=[O:20])[O:21][CH3:22])=[CH:23][OH:24])[cH:17]1.[OH2:10].[P:1]([O:2][P:3]([OH:4])([OH:5])=[O:6])([OH:7])([OH:8])=[O:9]>>[Cl:11][c:12]1[cH:13][cH:14][c:15]2[c:16]([cH:17]1)[C:18]([C:19](=[O:20])[O:21][CH3:22])=[CH:23][c:27]1[c:26]([cH:31][cH:30][cH:29][cH:28]1)[O:25]2

참가 물질

5

출처 및 근거

ORD 기록
ord-09e64eb22d834cef8b10d88a245f6d93
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

불러오는 중…