13-apo-beta-carotenone

Properties Image MNX_ID MNXM6051 reference chebi:53175 formula C18H26O global charge 0 mol weight 258.405 InChIKey UBTNVRPIHJRBCI-LUXGDSJYSA-N InChI InChI=1S/C18H26O/c1-14(8-6-10-16(3)19)11-12-17-15(2)9-7-13-18(17,4)5/h6,8,10-12H,7,9,13H2,1-5H3/b10-6+,12-11+,14-8+ SMILES CC(=O)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C MNX internals InChI (mnx) InChI=1/C18H26O/c1-14(8-6-10-16(3)19)11-12-17-15(2)9-7-13-18(17,4)5/h6,8,10-12H,7,9,13H2,1-5H3/b10-6+,12-11+,14-8+ SMILES (mnx) [CH3:1][C:14](=[CH:8]\[CH:6]=[CH:10]\[C:16]([CH3:3])=[O:19])/[CH:11]=[CH:12]/[C:17]1=[C:15]([CH3:2])[CH2:9][CH2:7][CH2:13][C:18]1([CH3:4])[CH3:5]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 1