Acetic Acid → HCID 14595362, compound

HRID 674077Notes

Reaction equation

HRID 674077 reaction equation
[CH3:31][C:32](=[O:33])[OH:34].[CH:22](=[O:23])[c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[ClH:30].[OH:1][CH2:2][CH:3]([CH:4]1[NH:5][CH2:6][CH2:7][c:8]2[cH:9][c:10]([O:17][CH2:18][CH3:19])[c:11]([O:14][CH2:15][CH3:16])[cH:12][c:13]21)[CH2:20][OH:21].[cH:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1>>[OH:1][CH2:2][CH:3]1[CH:4]2[N:5]([CH2:6][CH2:7][c:8]3[cH:9][c:10]([O:17][CH2:18][CH3:19])[c:11]([O:14][CH2:15][CH3:16])[cH:12][c:13]32)[CH:22]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[O:21][CH2:20]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 240BenzaldehydeHCID 241BenzeneHCID 313Hydrochloric AcidHCID 136966852-(6,7-Diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)propane-1,3-diol

Product 1

HCID 14595362HCID 14595362, compound

Sources & evidence

ORD record
ord-134cbff011714dc1afe5f79054a6b343
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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