Acetic Acid → HCID 178490859, compound
Reaction equation
[C:76]([O:77][BH-:78]([O:79][C:80](=[O:81])[CH3:82])[O:83][C:84](=[O:85])[CH3:86])(=[O:87])[CH3:88].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH:12]([CH3:13])[OH:14])[C:15]([NH:16][CH2:17][CH2:18][CH:19]=[O:20])=[O:21])=[O:22].[CH3:72][C:73](=[O:74])[OH:75].[NH2:23][CH:24]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH:32]([OH:33])[CH:34]1[O:35][CH:36]([n:55]2[c:56](=[O:71])[n:57]([CH2:62][c:63]3[cH:64][cH:65][c:66]([O:69][CH3:70])[cH:67][cH:68]3)[c:58](=[O:61])[cH:59][cH:60]2)[CH:37]([O:47][Si:48]([CH3:49])([CH3:50])[C:51]([CH3:52])([CH3:53])[CH3:54])[CH:38]1[O:39][Si:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[CH3:46].[Na+:89].[O:90]1[CH2:91][CH2:92][CH2:93][CH2:94]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH:12]([CH3:13])[OH:14])[C:15]([NH:16][CH2:17][CH2:18][CH2:19][NH:23][CH:24]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH:32]([OH:33])[CH:34]1[O:35][CH:36]([n:55]2[c:56](=[O:71])[n:57]([CH2:62][c:63]3[cH:64][cH:65][c:66]([O:69][CH3:70])[cH:67][cH:68]3)[c:58](=[O:61])[cH:59][cH:60]2)[CH:37]([O:47][Si:48]([CH3:49])([CH3:50])[C:51]([CH3:52])([CH3:53])[CH3:54])[CH:38]1[O:39][Si:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[CH3:46])=[O:21])=[O:22]Participants
7
Sources & evidence
- ORD record
- ord-664a5dbfd9e141f7bbbc165b6cd73273
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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