Potassium Cation → HCID 67274144, compound

HRID 1132575Notes

Reaction equation

HRID 1132575 reaction equation
[B-:43]([F:44])([F:45])([F:46])[F:47].[CH3:65][CH2:66][N:67]([CH2:68][CH3:69])[CH2:70][CH3:71].[K+:90].[K+:91].[N:72]1([CH:78]2[CH2:79][CH2:80][N:81]([CH2:84][C:85](=[O:86])[O:87][CH2:88][CH3:89])[CH2:82][CH2:83]2)[CH2:73][CH2:74][NH:75][CH2:76][CH2:77]1.[O-:92][C:93]([O-:94])=[O:95].[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:39][cH:40][cH:41][cH:42]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([CH2:19][c:20]2[cH:21][c:22]([CH3:35])[c:23]([O:27][CH2:28][c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[c:24]([CH3:26])[cH:25]2)[C:36](=[O:37])[OH:38])[CH2:13][CH2:14]1.[O:96]=[CH:97][N:98]([CH3:99])[CH3:100].[n:48]1([O:49][C:50]([N:51]([CH3:52])[CH3:53])=[N+:54]([CH3:55])[CH3:56])[c:57]2[cH:58][cH:59][cH:60][cH:61][c:62]2[n:63][n:64]1>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:39][cH:40][cH:41][cH:42]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([CH2:19][c:20]2[cH:21][c:22]([CH3:35])[c:23]([O:27][CH2:28][c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[c:24]([CH3:26])[cH:25]2)[C:36](=[O:37])[N:75]2[CH2:74][CH2:73][N:72]([CH:78]3[CH2:79][CH2:80][N:81]([CH2:84][C:85](=[O:86])[O:87][CH2:88][CH3:89])[CH2:82][CH2:83]3)[CH2:77][CH2:76]2)[CH2:13][CH2:14]1

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 8471TriethylamineHCID 19660Carbonate IonHCID 26255TetrafluoroborateHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 54188692HCID 54188692, compoundHCID 672732333-(3,5-dimethyl-4-phenylmethoxyphenyl)-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carbonyl]oxypropanoic acid

Product 1

HCID 67274144HCID 67274144, compound

Sources & evidence

ORD record
ord-4539fa95cdbc40a0b2f9d5b501b572e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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