Water → HCID 57636053, compound
Reaction equation
[C:23](=[O:24])([OH:25])[C:26]([CH3:27])([CH3:28])[c:29]1[cH:30][c:31]([B:35]([OH:36])[OH:37])[cH:32][cH:33][cH:34]1.[C:38](=[O:39])([O-:40])[O-:41].[CH3:44][O:45][CH2:46][CH2:47][O:48][CH3:49].[Cl:1][c:2]1[cH:3][c:4]([NH:10][CH2:11][CH:12]2[O:13][c:14]3[c:15]([cH:19][cH:20][cH:21][cH:22]3)[N:16]([CH3:18])[CH2:17]2)[n:5][c:6]([O:8][CH3:9])[n:7]1.[Cs+:42].[Cs+:43].[OH2:50].[cH:51]1[cH:52][cH:53][c:54]([P:55]([Pd:56]([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[P:95]([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[cH:126][cH:127]1>>[c:2]1(-[c:31]2[cH:30][c:29]([C:26]([C:23](=[O:24])[OH:25])([CH3:27])[CH3:28])[cH:34][cH:33][cH:32]2)[cH:3][c:4]([NH:10][CH2:11][CH:12]2[O:13][c:14]3[c:15]([cH:19][cH:20][cH:21][cH:22]3)[N:16]([CH3:18])[CH2:17]2)[n:5][c:6]([O:8][CH3:9])[n:7]1Participants
8
Sources & evidence
- ORD record
- ord-4c4f797b0d1d409f8b8f2619634b43e8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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