Acetic Acid → Diethyl [2-(4-(4-chlorobenzoyl)-2-oxo-1-[4-(2,5-dihydro-1H-pyrrol-1-ylcarbonyl)benzyl]-2,3,4,5-tetrahydro-1H-benzo-[e][1,4]-diazepin-8-yl)ethyl]phosphonate
Reaction equation
[C:54]([O:55][BH-:56]([O:57][C:58](=[O:59])[CH3:60])[O:61][C:62](=[O:63])[CH3:64])(=[O:65])[CH3:66].[CH3:50][C:51](=[O:52])[OH:53].[CH3:68][CH2:69][N:70]([CH2:71][CH3:72])[CH2:73][CH3:74].[CH3:80][CH2:81][OH:82].[CH3:83][CH2:84][O:85][C:86](=[O:87])[CH3:88].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[N:8]([CH2:9][c:10]2[c:11]([NH2:26])[cH:12][c:13]([CH2:16][CH2:17][P:18](=[O:19])([O:20][CH2:21][CH3:22])[O:23][CH2:24][CH3:25])[cH:14][cH:15]2)[CH2:27][C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:33][cH:34]1.[Cl:75][CH2:76][Cl:77].[N:35]1([C:40](=[O:41])[c:42]2[cH:43][cH:44][c:45]([CH:46]=[O:47])[cH:48][cH:49]2)[CH2:36][CH:37]=[CH:38][CH2:39]1.[Na+:67].[Na+:79].[OH-:78]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][c:10]3[c:11]([cH:12][c:13]([CH2:16][CH2:17][P:18](=[O:19])([O:20][CH2:21][CH3:22])[O:23][CH2:24][CH3:25])[cH:14][cH:15]3)[N:26]([CH2:46][c:45]3[cH:44][cH:43][c:42]([C:40]([N:35]4[CH2:36][CH:37]=[CH:38][CH2:39]4)=[O:41])[cH:49][cH:48]3)[C:28](=[O:29])[CH2:27]2)[cH:33][cH:34]1Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-58d573d2e8bb452c9044723936acfaa9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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