Hydrochloric Acid → HCID 11525899, compound

HRID 309014Notes

Reaction equation

HRID 309014 reaction equation
[C:29]([n:30]1[cH:31][cH:32][n:33][cH:34]1)([n:35]1[cH:36][cH:37][n:38][cH:39]1)=[O:40].[CH2:42]([CH3:43])[O:44][C:45]([CH2:46][CH2:47][NH2:48])=[O:49].[CH3:50][CH2:51][O:52][C:53]([CH3:54])=[O:55].[ClH:41].[O:1]1[CH2:2][CH2:3][CH:4]([CH2:7][n:8]2[cH:9][c:10]([C:20](=[O:21])[CH:22]3[C:23]([CH3:27])([CH3:28])[C:24]3([CH3:25])[CH3:26])[c:11]3[cH:12][cH:13][c:14]([C:17](=[O:18])[OH:19])[cH:15][c:16]23)[CH2:5][CH2:6]1.[OH2:56]>>[O:1]1[CH2:2][CH2:3][CH:4]([CH2:7][n:8]2[cH:9][c:10]([C:20](=[O:21])[CH:22]3[C:23]([CH3:27])([CH3:28])[C:24]3([CH3:25])[CH3:26])[c:11]3[cH:12][cH:13][c:14]([C:17](=[O:18])[NH:48][CH2:47][CH2:46][C:45]([O:44][CH2:42][CH3:43])=[O:49])[cH:15][c:16]23)[CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 962WaterHCID 8857Ethyl AcetateHCID 682631,1'-CarbonyldiimidazoleHCID 419889Ethyl 3-aminopropanoateHCID 11574517HCID 11574517, compound

Product 1

HCID 11525899HCID 11525899, compound

Sources & evidence

ORD record
ord-5c8062014e77486bb465fff9aa1fe2ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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