Acetic Acid → HCID 22260415, compound

HRID 2148036Notes

Reaction equation

HRID 2148036 reaction equation
[C:2](#[N:3])[C:4]1([NH:10][C:11](=[O:12])[CH:13]([CH2:14][C:15]([CH3:16])([CH3:17])[CH3:18])[NH:19][C:20](=[O:21])[N:22]2[CH2:23][CH2:24][O:25][CH2:26][CH2:27]2)[CH2:5][CH2:6][NH:7][CH2:8][CH2:9]1.[C:35]([OH:36])(=[O:37])[CH3:38].[C:44](=[O:45])([OH:46])[O-:47].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[ClH:1].[Na+:48].[O:28]=[C:29]1[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]1>>[C:2](#[N:3])[C:4]1([NH:10][C:11](=[O:12])[CH:13]([CH2:14][C:15]([CH3:16])([CH3:17])[CH3:18])[NH:19][C:20](=[O:21])[N:22]2[CH2:23][CH2:24][O:25][CH2:26][CH2:27]2)[CH2:5][CH2:6][N:7]([CH:29]2[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]2)[CH2:8][CH2:9]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 7967CyclohexanoneHCID 8028TetrahydrofuranHCID 20737703HCID 20737703, compound

Product 1

HCID 22260415HCID 22260415, compound

Sources & evidence

ORD record
ord-4489e2d178b04e67988c0d3aeebf3a20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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