compound 0080166

Properties Image MNX_ID MNXM1190729 reference envipathM:...dd03032a85a2 formula C20H26O4 global charge 0 mol weight 330.424 InChIKey ZYNTUONKPATPFX-UHFFFAOYSA-N InChI InChI=1S/C20H26O4/c1-3-20(24)7-5-15-13-9-16(21)14-10-18(23)17(22)8-12(14)11(13)4-6-19(15,20)2/h3,8,10-11,13,15-16,21-24H,1,4-7,9H2,2H3 SMILES C=CC1(O)CCC2C3CC(O)C4=C(C=C(O)C(O)=C4)C3CCC21C MNX internals InChI (mnx) InChI=1/C20H26O4/c1-3-20(24)7-5-15-13-9-16(21)14-10-18(23)17(22)8-12(14)11(13)4-6-19(15,20)2/h3,8,10-11,13,15-16,21-24H,1,4-7,9H2,2H3/t11?,13?,15?,16?,19?,20? SMILES (mnx) [CH2:1]=[CH:3][C:20]1([OH:24])[CH2:7][CH2:5][CH:15]2[CH:13]3[CH2:9][CH:16]([OH:21])[C:14]4=[CH:10][C:18]([OH:23])=[C:17]([OH:22])[CH:8]=[C:12]4[CH:11]3[CH2:4][CH2:6][C:19]21[CH3:2]

Parent-child relations graph

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