1.0 2010-04-08 22:14:36 UTC 2019-11-26 03:17:52 UTC FDB019807 (all-E)-6'-Apo-y-caroten-6'-al Isolated from Lycopersicon esculentum (tomato). (all-E)-6'-Apo-y-caroten-6'-al is found in garden tomato and garden tomato (variety). 6'-Apo-psi,psi-carotenal C32H42O 442.6753 442.323565966 (2E,4E,6E,8E,10E,12E,14E,16E,18E,20E)-4,8,13,17,21,25-hexamethylhexacosa-2,4,6,8,10,12,14,16,18,20,24-undecaenal (2E,4E,6E,8E,10E,12E,14E,16E,18E,20E)-4,8,13,17,21,25-hexamethylhexacosa-2,4,6,8,10,12,14,16,18,20,24-undecaenal 22255-36-3 CC(C)=CCC\C(C)=C\C=C\C(\C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C=O InChI=1S/C32H42O/c1-27(2)15-10-18-30(5)21-13-23-31(6)22-11-19-28(3)16-8-9-17-29(4)20-12-24-32(7)25-14-26-33/h8-9,11-17,19-26H,10,18H2,1-7H3/b9-8+,19-11+,20-12+,23-13+,25-14+,28-16+,29-17+,30-21+,31-22+,32-24+ ZXEPHOYZDSLBJV-CQOAVJQGSA-N belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Triterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Triterpenoids Aliphatic acyclic compounds Aldehydes Enals Fatty aldehydes Hydrocarbon derivatives Organic oxides Aldehyde Aliphatic acyclic compound Alpha,beta-unsaturated aldehyde Carbonyl group Enal Fatty acyl Fatty aldehyde Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Triterpenoid logp 7.99 ALOGPS logs -5.81 ALOGPS solubility 6.82e-04 g/l ALOGPS melting_point Mp 147° logp 8.38 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac (2E,4E,6E,8E,10E,12E,14E,16E,18E,20E)-4,8,13,17,21,25-hexamethylhexacosa-2,4,6,8,10,12,14,16,18,20,24-undecaenal ChemAxon average_mass 442.6753 ChemAxon mono_mass 442.323565966 ChemAxon smiles CC(C)=CCC\C(C)=C\C=C\C(\C)=C\C=C\C(\C)=C\C=C\C=C(/C)\C=C\C=C(/C)\C=C\C=O ChemAxon formula C32H42O ChemAxon inchi InChI=1S/C32H42O/c1-27(2)15-10-18-30(5)21-13-23-31(6)22-11-19-28(3)16-8-9-17-29(4)20-12-24-32(7)25-14-26-33/h8-9,11-17,19-26H,10,18H2,1-7H3/b9-8+,19-11+,20-12+,23-13+,25-14+,28-16+,29-17+,30-21+,31-22+,32-24+ ChemAxon inchikey ZXEPHOYZDSLBJV-CQOAVJQGSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 160.12 ChemAxon polarizability 58.24 ChemAxon rotatable_bond_count 13 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15754 Specdb::CMs 135112 Specdb::CMs 142846 Specdb::MsMs 300934 Specdb::MsMs 300935 Specdb::MsMs 300936 Specdb::MsMs 343324 Specdb::MsMs 343325 Specdb::MsMs 343326 Specdb::MsMs 2403467 Specdb::MsMs 2403468 Specdb::MsMs 2403469 Specdb::MsMs 2535632 Specdb::MsMs 2535633 Specdb::MsMs 2535634 HMDB40118 #<Reference:0x000055ce32ba4338> Garden tomato Type 1 specific Solanum lycopersicum 4081 Garden tomato (var.) Type 1 specific Solanum lycopersicum var. lycopersicum 397755