Hydrochloric Acid → HCID 178467613, compound

HRID 299993Notes

Reaction equation

HRID 299993 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]1[CH2:9][N:10]([c:13]2[n:14][c:15]([NH:42][CH2:43][CH:44]([c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[c:51]3[cH:52][cH:53][cH:54][cH:55][cH:56]3)[c:16]3[n:17][cH:18][n:19]([CH:22]4[CH:23]([OH:41])[CH:24]([OH:40])[CH:25]([NH:27][C:28]([CH:29]([CH3:30])[O:31][CH2:32][c:33]5[cH:34][cH:35][cH:36][cH:37][cH:38]5)=[O:39])[CH2:26]4)[c:20]3[n:21]2)[CH2:11][CH2:12]1)([CH3:5])([CH3:6])[CH3:57].[CH3:59][OH:60].[ClH:58].[O:61]1[CH2:62][CH2:63][O:64][CH2:65][CH2:66]1>>[NH2:7][CH:8]1[CH2:9][N:10]([c:13]2[n:14][c:15]([NH:42][CH2:43][CH:44]([c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[c:51]3[cH:52][cH:53][cH:54][cH:55][cH:56]3)[c:16]3[n:17][cH:18][n:19]([CH:22]4[CH:23]([OH:41])[CH:24]([OH:40])[CH:25]([NH:27][C:28]([CH:29]([CH3:30])[O:31][CH2:32][c:33]5[cH:34][cH:35][cH:36][cH:37][cH:38]5)=[O:39])[CH2:26]4)[c:20]3[n:21]2)[CH2:11][CH2:12]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 66633761HCID 66633761, compound

Product 1

HCID 178467613HCID 178467613, compound

Sources & evidence

ORD record
ord-d11466dd05be445c9f9cb38559d83593
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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