Acetic Acid → HCID 19348805, compound

HRID 1228510Notes

Reaction equation

HRID 1228510 reaction equation
[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[c:7]([NH:14][C:15]([CH2:16][CH:17]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:23]2[c:24]([O:31][CH3:32])[cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)=[O:33])[cH:8][c:9]([CH2:12][NH2:13])[cH:10][cH:11]1.[CH3:44][C:45](=[O:46])[OH:47].[ClH:1].[K:34][O:35][C:36]#[N:37].[Na+:39].[OH2:38].[OH:40][C:41](=[O:42])[O-:43]>>[C:2]([CH3:3])([CH3:4])([CH3:5])[c:6]1[c:7]([NH:14][C:15]([CH2:16][CH:17]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:23]2[c:24]([O:31][CH3:32])[cH:25][c:26]([O:29][CH3:30])[cH:27][cH:28]2)=[O:33])[cH:8][c:9]([CH2:12][NH:13][C:36](=[O:35])[NH2:37])[cH:10][cH:11]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 19348478HCID 19348478, compoundHCID 178418250HCID 178418250, compound

Product 1

HCID 19348805HCID 19348805, compound

Sources & evidence

ORD record
ord-6e24b2b3fda24dbcaf93985d8491891e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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