Acetic Acid → HCID 23107155, compound

HRID 1563317Notes

Reaction equation

HRID 1563317 reaction equation
[CH2:22]1[CH2:23][NH:24][CH2:25][CH2:26]1.[CH3:16][OH:17].[CH3:18][C:19]([CH3:20])=[O:21].[CH3:27][CH2:28][O:29][CH2:30][CH3:31].[CH3:33][C:34](=[O:35])[OH:36].[CH3:42][CH2:43][OH:44].[CH:1]12[CH:2]([C:11]3=[CH:12][CH:13]=[CH:14][CH2:15]3)[CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[O:37]1[CH2:38][CH2:39][CH2:40][CH2:41]1.[OH2:32]>>[CH:1]12[CH:2]([C:11]3=[CH:12][C:13](=[C:19]([CH3:18])[CH3:20])[CH:14]=[CH:15]3)[CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 180AcetoneHCID 702EthanolHCID 887MethanolHCID 962WaterHCID 3283Diethyl EtherHCID 8028TetrahydrofuranHCID 31268PyrrolidineHCID 23436668HCID 23436668, compound

Product 1

HCID 23107155HCID 23107155, compound

Sources & evidence

ORD record
ord-039fb7446458421ea41cbbfdebf229d7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…