Diasarone 2

Properties Image MNX_ID MNXM124800 reference hmdb:HMDB0039145 formula C24H32O6 global charge 0 mol weight 416.514 InChIKey ZPOQFZFDKXZAGL-UHFFFAOYSA-N InChI InChI=1S/C24H32O6/c1-9-14-13(2)21(15-10-17(26-4)18(27-5)11-16(15)25-3)23-22(14)19(28-6)12-20(29-7)24(23)30-8/h10-14,21H,9H2,1-8H3 SMILES CCC1C2=C(OC)C=C(OC)C(OC)=C2C(C2=CC(OC)=C(OC)C=C2OC)C1C MNX internals InChI (mnx) InChI=1/C24H32O6/c1-9-14-13(2)21(15-10-17(26-4)18(27-5)11-16(15)25-3)23-22(14)19(28-6)12-20(29-7)24(23)30-8/h10-14,21H,9H2,1-8H3/t13?,14?,21? SMILES (mnx) [CH3:1][CH2:9][CH:14]1[CH:13]([CH3:2])[CH:21]([C:15]2=[CH:10][C:17]([O:26][CH3:4])=[C:18]([O:27][CH3:5])[CH:11]=[C:16]2[O:25][CH3:3])[C:23]2=[C:22]1[C:19]([O:28][CH3:6])=[CH:12][C:20]([O:29][CH3:7])=[C:24]2[O:30][CH3:8]

Parent-child relations graph

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