Hydrochloric Acid → HCID 178446560, compound

HRID 118039Notes

Reaction equation

HRID 118039 reaction equation
[CH2:53]([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)[NH:60][CH2:61][CH:62]([CH:63]([CH2:64][CH:65]([CH3:66])[CH3:67])[NH2:68])[OH:69].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:70][N:71]([CH3:72])[CH:73]=[O:74].[CH3:75][CH:76]([CH2:77][CH2:78][O:79][N:80]=[O:81])[CH3:82].[ClH:51].[ClH:52].[N-:48]=[N+:49]=[N-:50].[N-:8]=[N+:9]=[N-:10].[c:11]1([CH2:21][CH:22]([C:23](=[O:24])[NH:25][CH:26]([CH2:27][c:28]2[cH:29][nH:30][cH:31][n:32]2)[C:33](=[O:34])[OH:35])[CH2:36][C:37]([NH:38][CH2:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)=[O:47])[cH:12][cH:13][cH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12>>[c:11]1([CH2:21][CH:22]([C:23](=[O:24])[NH:25][CH:26]([CH2:27][c:28]2[cH:29][nH:30][cH:31][n:32]2)[C:33](=[O:34])[NH:68][CH:63]([CH:62]([CH2:61][NH:60][CH2:53][c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[OH:69])[CH2:64][CH:65]([CH3:66])[CH3:67])[CH2:36][C:37]([NH:38][CH2:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)=[O:47])[cH:12][cH:13][cH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 8053Isoamyl NitriteHCID 8471TriethylamineHCID 33558Azide2×HCID 200371033-Amino-1-(benzylamino)-5-methylhexan-2-olHCID 178520535HCID 178520535, compound

Product 1

HCID 178446560HCID 178446560, compound

Sources & evidence

ORD record
ord-eae104bf17df4cb9a80224b0235bfe35
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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