4-hydroxy-6-(13-methyl-2-oxononadecyl)pyran-2-one

Properties Image MNX_ID MNXM146952 reference chebi:85498 formula C25H42O4 global charge 0 mol weight 406.607 InChIKey GYNSQXCBPSRCAW-UHFFFAOYSA-N InChI InChI=1S/C25H42O4/c1-3-4-5-12-15-21(2)16-13-10-8-6-7-9-11-14-17-22(26)18-24-19-23(27)20-25(28)29-24/h19-21,27H,3-18H2,1-2H3 SMILES CCCCCCC(C)CCCCCCCCCCC(=O)CC1=CC(O)=CC(=O)O1 MNX internals InChI (mnx) InChI=1/C25H42O4/c1-3-4-5-12-15-21(2)16-13-10-8-6-7-9-11-14-17-22(26)18-24-19-23(27)20-25(28)29-24/h19-21,27H,3-18H2,1-2H3/t21? SMILES (mnx) [CH3:1][CH2:3][CH2:4][CH2:5][CH2:12][CH2:15][CH:21]([CH3:2])[CH2:16][CH2:13][CH2:10][CH2:8][CH2:6][CH2:7][CH2:9][CH2:11][CH2:14][CH2:17][C:22]([CH2:18][C:24]1=[CH:19][C:23]([OH:27])=[CH:20][C:25](=[O:28])[O:29]1)=[O:26]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1