Hydrochloric Acid → HCID 178483191, compound

HRID 1113788Notes

Reaction equation

HRID 1113788 reaction equation
[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[NH:20][C:21]([CH2:22][CH:23]=[CH:24][C:25](=[O:26])[OH:27])([CH3:28])[CH3:29].[CH2:70]([N:71]([CH:72]([CH3:73])[CH3:74])[CH:75]([CH3:76])[CH3:77])[CH3:78].[CH3:2][N:3]([CH3:4])[CH2:5][CH2:6][CH2:7][N:8]=[C:9]=[N:10][CH2:11][CH3:12].[CH3:79][N:80]([CH3:81])[CH:82]=[O:83].[CH3:87][CH2:88][O:89][C:90](=[O:91])[CH3:92].[Cl:84][CH2:85][Cl:86].[ClH:1].[OH:30][n:31]1[c:32]2[n:33][cH:34][cH:35][cH:36][c:37]2[n:38][n:39]1.[OH:40][CH2:41][CH2:42][O:43][c:44]1[c:45]([CH2:50][CH2:51][N:52]([C:53]([CH:54]([CH2:55][c:56]2[cH:57][c:58]3[cH:59][cH:60][cH:61][cH:62][c:63]3[cH:64][cH:65]2)[NH:66][CH3:67])=[O:68])[CH3:69])[cH:46][cH:47][cH:48][cH:49]1>>[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18](=[O:19])[NH:20][C:21]([CH2:22][CH:23]=[CH:24][C:25](=[O:27])[N:66]([CH:54]([C:53]([N:52]([CH2:51][CH2:50][c:45]1[c:44]([O:43][CH2:42][CH2:41][OH:40])[cH:49][cH:48][cH:47][cH:46]1)[CH3:69])=[O:68])[CH2:55][c:56]1[cH:57][c:58]2[cH:59][cH:60][cH:61][cH:62][c:63]2[cH:64][cH:65]1)[CH3:67])([CH3:28])[CH3:29]

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 81531DiisopropylethylamineHCID 181649HOAtHCID 541269175-Methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-2-enoic acidHCID 178483152HCID 178483152, compound

Product 1

HCID 178483191HCID 178483191, compound

Sources & evidence

ORD record
ord-e43c5413ca604d4cacd444c3ae803ab3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…