Hydrochloric Acid → HCID 178473204, compound

HRID 315313Notes

Reaction equation

HRID 315313 reaction equation
[C:56](=[O:57])([O-:58])[OH:59].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:54][CH3:55])[CH2:8][CH:9]([NH:20][c:21]2[n:22][cH:23][c:24]([NH:42][CH2:43][CH:44]([C:45](=[O:46])[O:47][C:48]([CH3:49])([CH3:50])[CH3:51])[CH2:52][CH3:53])[c:25]([CH2:27][c:28]3[cH:29][c:30]([C:38]([F:39])([F:40])[F:41])[cH:31][c:32]([C:34]([F:35])([F:36])[F:37])[cH:33]3)[n:26]2)[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][c:15]21.[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[ClH:61].[Na+:60]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:54][CH3:55])[CH2:8][CH:9]([NH:20][c:21]2[n:22][cH:23][c:24]([NH:42][CH2:43][CH:44]([C:45](=[O:46])[OH:47])[CH2:52][CH3:53])[c:25]([CH2:27][c:28]3[cH:29][c:30]([C:38]([F:39])([F:40])[F:41])[cH:31][c:32]([C:34]([F:35])([F:36])[F:37])[cH:33]3)[n:26]2)[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][c:15]21

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 8857Ethyl AcetateHCID 178473205HCID 178473205, compound

Product 1

HCID 178473204HCID 178473204, compound

Sources & evidence

ORD record
ord-6a6a4d34b22a4eafb29f8709d2659d2d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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