Hydrochloric Acid → HCID 86745686, compound

HRID 186268Notes

Reaction equation

HRID 186268 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH2:8][O:9][c:10]1[c:11]([CH3:48])[c:12]2[c:17]([c:18]([CH3:21])[c:19]1[CH3:20])[O:16][C:15]([CH3:22])([CH2:23][O:24][c:25]1[cH:26][cH:27][c:28]([CH2:29][CH:30]3[C:31](=[O:44])[N:32]([CH2:36][C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:33](=[O:35])[S:34]3)[cH:45][cH:46]1)[CH2:14][C:13]2=[O:47].[C:58](=[O:59])([O-:60])[O-:61].[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[CH3:70][OH:71].[ClH:49].[K+:62].[K+:63].[NH2:50][OH:51].[cH:52]1[cH:53][cH:54][n:55][cH:56][cH:57]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH2:8][O:9][c:10]1[c:11]([CH3:48])[c:12]2[c:17]([c:18]([CH3:21])[c:19]1[CH3:20])[O:16][C:15]([CH3:22])([CH2:23][O:24][c:25]1[cH:26][cH:27][c:28]([CH2:29][CH:30]3[C:31](=[O:44])[N:32]([CH2:36][C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:33](=[O:35])[S:34]3)[cH:45][cH:46]1)[CH2:14][C:13]2=[N:50][OH:51]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 787HydroxylamineHCID 813Potassium Cation2×HCID 887MethanolHCID 1049PyridineHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 19822186HCID 19822186, compound

Product 1

HCID 86745686HCID 86745686, compound

Sources & evidence

ORD record
ord-6ef161ade8f04f1a881bcb5c0550ab07
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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