Hydrochloric Acid → HCID 10145952, compound

HRID 1141420Notes

Reaction equation

HRID 1141420 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][CH:7]2[N:8]([CH:22]([C:23](=[O:24])[OH:25])[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[CH2:9][CH2:10][CH2:11][c:12]3[c:13]2[cH:14][c:15]([O:20][CH3:21])[c:16]([O:18][CH3:19])[cH:17]3)[cH:32][cH:33][c:34]1[O:35][CH3:36].[ClH:37].[ClH:38].[c:39]1([CH2:49][NH2:50])[n:40][cH:41][cH:42][c:43]2[cH:44][cH:45][cH:46][cH:47][c:48]12>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH2:6][CH:7]2[N:8]([CH:22]([C:23](=[O:25])[NH:50][CH2:49][c:39]3[n:40][cH:41][cH:42][c:43]4[cH:44][cH:45][cH:46][cH:47][c:48]34)[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[CH2:9][CH2:10][CH2:11][c:12]3[c:13]2[cH:14][c:15]([O:20][CH3:21])[c:16]([O:18][CH3:19])[cH:17]3)[cH:32][cH:33][c:34]1[O:35][CH3:36]

Participants

4

Reactant 3

HCID 313Hydrochloric Acid2×HCID 1419103isoquinolin-1-ylmethanamineHCID 18442565[1-(3,4-Dimethoxy-benzyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-benzo[c]azepin-2-yl]-phenyl-acetic acid

Product 1

HCID 10145952HCID 10145952, compound

Sources & evidence

ORD record
ord-5b6dc2beaafb42b994c76dae8ec112a1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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