compound 0040972

Properties Image MNX_ID MNXM503350 reference envipathM:...d81bad57aa08 formula C24H32O5 global charge 0 mol weight 400.515 InChIKey SAMQSARYEVIZJL-UHFFFAOYSA-N InChI InChI=1S/C24H32O5/c1-3-4-5-6-7-8-9-10-11-12-17-21-23(28-18(2)25)22(26)19-15-13-14-16-20(19)24(27)29-21/h13-16H,3-12,17H2,1-2H3 SMILES CCCCCCCCCCCCC1=C(OC(C)=O)C(=O)C2=C(C=CC=C2)C(=O)O1 MNX internals InChI (mnx) InChI=1/C24H32O5/c1-3-4-5-6-7-8-9-10-11-12-17-21-23(28-18(2)25)22(26)19-15-13-14-16-20(19)24(27)29-21/h13-16H,3-12,17H2,1-2H3 SMILES (mnx) [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:17][C:21]1=[C:23]([O:28][C:18]([CH3:2])=[O:25])[C:22](=[O:26])[C:19]2=[CH:15][CH:13]=[CH:14][CH:16]=[C:20]2[C:24](=[O:27])[O:29]1

Parent-child relations graph

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