Titanium cation (4+) → HCID 178447124, 화합물

HRID 93024

반응식

HRID 93024 반응식
[CH3:35][C:36]([CH3:37])([O-:38])[CH3:39].[CH3:41][C:42]([CH3:43])([O-:44])[CH3:45].[CH3:46][C:47]([CH3:48])([O-:49])[CH3:50].[CH3:51][C:52]([CH3:53])([O-:54])[CH3:55].[F:1][c:2]1[c:3]([CH3:22])[c:4]([O:20][CH3:21])[c:5]([CH:8]([CH2:9][C:10]([CH:11]=[O:12])([C:13]([F:14])([F:15])[F:16])[OH:17])[CH2:18][CH3:19])[cH:6][cH:7]1.[NH2:23][c:24]1[c:25]2[cH:26][cH:27][c:28](=[O:34])[nH:29][c:30]2[cH:31][cH:32][cH:33]1.[Ti+4:40]>>[F:1][c:2]1[c:3]([CH3:22])[c:4]([O:20][CH3:21])[c:5]([CH:8]([CH2:9][C:10]([CH:11]=[N:23][c:24]2[c:25]3[cH:26][cH:27][c:28](=[O:34])[nH:29][c:30]3[cH:31][cH:32][cH:33]2)([C:13]([F:14])([F:15])[F:16])[OH:17])[CH2:18][CH3:19])[cH:6][cH:7]1

참가 물질

5

출처 및 근거

ORD 기록
ord-9841b904e6604434b105423b23d5a9c4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

불러오는 중…