18-[2-[4-(Isopropyl)thiazol-2-yl]-7-methoxyquinolin-4-yloxy]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxylic acid → HCID 75050637, compound
Reaction equation
[CH:23]([c:24]1[n:25][c:26](-[c:27]2[cH:28][c:29]([O:30][CH:42]3[CH2:43][N:44]4[C:45](=[O:65])[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH:52]=[CH:53][CH:54]5[CH2:55][C:56]5([C:62](=[O:63])[OH:64])[NH:57][C:58](=[O:61])[CH:59]4[CH2:60]3)[c:31]3[c:32]([cH:33][c:34]([O:35][CH3:36])[cH:37][cH:38]3)[n:39]2)[s:40][cH:41]1)([CH3:66])[CH3:67].[OH:1][c:2]1[cH:3][c:4](-[c:14]2[n:15][c:16]([NH:19][CH:20]([CH3:21])[CH3:22])[s:17][cH:18]2)[n:5][c:6]2[cH:7][c:8]([O:12][CH3:13])[cH:9][cH:10][c:11]12>>[O:1]([c:2]1[cH:3][c:4](-[c:14]2[n:15][c:16]([NH:19][CH:20]([CH3:21])[CH3:22])[s:17][cH:18]2)[n:5][c:6]2[cH:7][c:8]([O:12][CH3:13])[cH:9][cH:10][c:11]12)[CH:42]1[CH2:43][N:44]2[C:45](=[O:65])[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH:52]=[CH:53][CH:54]3[CH2:55][C:56]3([C:62](=[O:63])[OH:64])[NH:57][C:58](=[O:61])[CH:59]2[CH2:60]1Participants
3
Sources & evidence
- ORD record
- ord-ccb2b0c8d9a142a5b22fe028688192fc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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