Crotaramosmin

Properties Image MNX_ID MNXM47822 reference lipidmapsM:LMPK12140102 formula C20H20O4 global charge 0 mol weight 324.376 InChIKey DTZBWBKUXVNGMX-UHFFFAOYSA-N InChI InChI=1S/C20H20O4/c1-12(2)3-4-14-7-10-17-19(20(14)23)16(22)11-18(24-17)13-5-8-15(21)9-6-13/h3,5-10,18,21,23H,4,11H2,1-2H3 SMILES CC(C)=CCC1=CC=C2OC(C3=CC=C(O)C=C3)CC(=O)C2=C1O MNX internals InChI (mnx) InChI=1/C20H20O4/c1-12(2)3-4-14-7-10-17-19(20(14)23)16(22)11-18(24-17)13-5-8-15(21)9-6-13/h3,5-10,18,21,23H,4,11H2,1-2H3/t18? SMILES (mnx) [CH3:1][C:12]([CH3:2])=[CH:3][CH2:4][C:14]1=[C:20]([OH:23])[C:19]2=[C:17]([CH:10]=[CH:7]1)[O:24][CH:18]([C:13]1=[CH:6][CH:9]=[C:15]([OH:21])[CH:8]=[CH:5]1)[CH2:11][C:16]2=[O:22]

Parent-child relations graph

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