(2-(2-Methoxyethoxy)ethoxy)acetic acid → HCID 22890682, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][C:6](=[O:7])[CH:8]1[N:9]([CH2:18][CH:19]([CH:20]([CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[NH:28][C:29]([CH:30]([NH:31][C:32]([c:33]2[cH:34][c:35]([C:39]#[N:40])[cH:36][cH:37][cH:38]2)=[O:41])[C:42]([CH3:43])([CH3:44])[S:45](=[O:46])(=[O:47])[CH3:48])=[O:49])[OH:50])[CH2:10][CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][CH:16]2[CH2:17]1.[CH3:51][O:52][CH2:53][CH2:54][O:55][CH2:56][CH2:57][O:58][CH2:59][C:60](=[O:61])[OH:62]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][C:6](=[O:7])[CH:8]1[N:9]([CH2:18][CH:19]([CH:20]([CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[NH:28][C:29]([CH:30]([NH:31][C:32]([c:33]2[cH:34][c:35]([C:39]#[N:40])[cH:36][cH:37][cH:38]2)=[O:41])[C:42]([CH3:43])([CH3:44])[S:45](=[O:46])(=[O:47])[CH3:48])=[O:49])[O:50][C:60]([CH2:59][O:58][CH2:57][CH2:56][O:55][CH2:54][CH2:53][O:52][CH3:51])=[O:61])[CH2:10][CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][CH:16]2[CH2:17]1Participants
3
Sources & evidence
- ORD record
- ord-3ffd8e752792457ab0d51c3abbf11fce
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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