Tetrahydrofuran → HCID 178504936, compound

HRID 120854Notes

Reaction equation

HRID 120854 reaction equation
[B-:36]([F:37])([F:38])([F:39])[F:40].[CH2:58]([N:59]([CH:60]([CH3:61])[CH3:62])[CH:63]([CH3:64])[CH3:65])[CH3:66].[CH2:83]1[O:84][CH2:85][CH2:86][CH2:87]1.[CH3:67][S:68](=[O:69])(=[O:70])[N:71]1[CH2:72][CH2:73][CH:74]([CH:77]2[CH2:78][CH2:79][NH:80][CH2:81][CH2:82]2)[CH2:75][CH2:76]1.[CH3:88][CH2:89][O:90][C:91]([CH3:92])=[O:93].[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:32][cH:33][cH:34][cH:35]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]([Br:28])[c:23]([OH:27])[c:24]([Br:26])[cH:25]2)[C:29](=[O:30])[OH:31])[CH2:13][CH2:14]1.[n:41]1([O:42][C:43]([N:44]([CH3:45])[CH3:46])=[N+:47]([CH3:48])[CH3:49])[c:50]2[cH:51][cH:52][cH:53][cH:54][c:55]2[n:56][n:57]1>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:32][cH:33][cH:34][cH:35]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]([Br:28])[c:23]([OH:27])[c:24]([Br:26])[cH:25]2)[C:29](=[O:30])[N:80]2[CH2:79][CH2:78][CH:77]([CH:74]3[CH2:73][CH2:72][N:71]([S:68]([CH3:67])(=[O:69])=[O:70])[CH2:76][CH2:75]3)[CH2:82][CH2:81]2)[CH2:13][CH2:14]1

Participants

8

Reactant 7

HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 47782601-(Methylsulfonyl)-4,4'-bipiperidineHCID 673018823-(3,5-dibromo-4-hydroxyphenyl)-2-[4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carbonyl]oxypropanoic acid

Product 1

HCID 178504936HCID 178504936, compound

Sources & evidence

ORD record
ord-e053a40202484355abca5eaf892f8846
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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