Ethanol → HCID 178435059, compound

HRID 2322492Notes

Reaction equation

[CH3:28][CH2:29][OH:30].[O:1]=[C:2]([CH:3]=[CH:4][c:5]1[cH:6][cH:7][c:8]([CH2:11][CH2:12][C:13](=[O:14])[OH:15])[cH:9][cH:10]1)[c:16]1[c:17]2[c:21]([c:22]([CH3:24])[s:23]1)[CH:20]1[CH:19]([CH2:18]2)[C:25]1([CH3:26])[CH3:27]>>[O:1]=[C:2]([CH2:3][CH2:4][c:5]1[cH:6][cH:7][c:8]([CH2:11][CH2:12][C:13](=[O:14])[OH:15])[cH:9][cH:10]1)[c:16]1[c:17]2[c:21]([c:22]([CH3:24])[s:23]1)[CH:20]1[CH:19]([CH2:18]2)[C:25]1([CH3:26])[CH3:27]

Participants

Reactant 2

HCID 702Ethanol

HCID 1784350583-[4-[3-oxo-3-(3,3,9-trimethyl-8-thiatricyclo[4.3.0.02,4]nona-1(9),6-dien-7-yl)prop-1-enyl]phenyl]propanoic acid

Product 1

HCID 178435059HCID 178435059, compound

Sources & evidence

ORD record: ord-74e6434d758a44808b936528e0f599bc
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…