Hydrochloric Acid → HCID 136146939, compound

HRID 1556370Notes

Reaction equation

HRID 1556370 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]([CH3:37])[n:8]([CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[c:9](=[O:30])[c:10]1[CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[c:19](-[c:24]3[n:25][o:26][c:27](=[O:29])[nH:28]3)[cH:20][cH:21][cH:22][cH:23]2)[cH:16][cH:17]1.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH3:52][CH2:53][OH:54].[ClH:45].[Na+:39].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH-:38]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]([CH3:37])[n:8]([CH2:31][C:32](=[O:33])[OH:34])[c:9](=[O:30])[c:10]1[CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[c:19](-[c:24]3[n:25][o:26][c:27](=[O:29])[nH:28]3)[cH:20][cH:21][cH:22][cH:23]2)[cH:16][cH:17]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 136146761HCID 136146761, compound

Product 1

HCID 136146939HCID 136146939, compound

Sources & evidence

ORD record
ord-6005aaee20f34da79ff2b3e14068bb85
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…