Hydrochloric Acid → HCID 178441675, compound

HRID 664986Notes

Reaction equation

HRID 664986 reaction equation
[CH2:47]([N:48]=[C:49]=[N:50][CH2:51][CH2:52][CH2:53][N:54]([CH3:55])[CH3:56])[CH3:57].[CH3:2][CH2:3][CH2:4][CH2:5][c:6]1[n:7][c:8]([Cl:9])[c:10]([CH2:11][OH:12])[n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18](-[c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]2-[c:27]2[n:28][n:29][n:30][nH:31]2)[cH:19][cH:20]1.[CH3:32][O:33][CH:34]1[CH2:35][CH:36]([C:43](=[O:44])[OH:45])[CH2:37][CH:38]1[O:39][N+:40](=[O:41])[O-:42].[CH3:58][N:59]1[CH2:60][CH2:61][O:62][CH2:63][CH2:64]1.[CH3:68][N:69]([CH3:70])[c:71]1[cH:72][cH:73][n:74][cH:75][cH:76]1.[Cl:65][CH2:66][Cl:67].[ClH:46].[K:1]>>[CH3:2][CH2:3][CH2:4][CH2:5][c:6]1[n:7][c:8]([Cl:9])[c:10]([CH2:11][O:12][C:43]([CH:36]2[CH2:35][CH:34]([O:33][CH3:32])[CH:38]([O:39][N+:40](=[O:41])[O-:42])[CH2:37]2)=[O:44])[n:13]1[CH2:14][c:15]1[cH:16][cH:17][c:18](-[c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]2-[c:27]2[nH:28][n:29][n:30][n:31]2)[cH:19][cH:20]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 79724-MethylmorpholineHCID 142844-(Dimethylamino)pyridineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 5462222PotassiumHCID 46220317(1RS,3RS,4SR)-3-methoxy-4-(nitrooxy)cyclopentanecarboxylic acidHCID 178441684HCID 178441684, compound

Product 1

HCID 178441675HCID 178441675, compound

Sources & evidence

ORD record
ord-79ac52ddff8e40be9e3f68af3e44cbe8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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