1.0 2010-04-08 22:12:05 UTC 2019-11-26 03:12:19 UTC FDB015844 beta-Carotinal Constituent of orange peel, spinach, marigolds and egg yolks. Colour additive. beta-Carotinal is found in many foods, some of which are eggs, green vegetables, sweet orange, and citrus. β-apo-8'-Carotenal 8'-Apo-beta-caroten-8'-al 8'-apo-beta-carotenal 8'-Apo-beta-carotenal, all-trans- 8'-Apo-beta,psi-carotenal 8'Apo-beta,psi-carotenal all-trans-8'-Apo-beta-carotenal all-trans-beta-Apo-8'-carotenal Apocarotenal b-Apo-2-carotinal b-Carotinal beta -Apo-8'-carotenal beta-apo-8'-carotenal beta-Apo-8'-carotenal (C30) Beta-apo-carotenal Beta-apocarotenal C Orange 16 C.I. Food Orange 6 Food orange 6 trans-beta-Apo-8'-carotenal C30H40O 416.638 416.307915902 (2E,4E,6E,8E,10E,12E,14Z,16E)-2,6,11,15-tetramethyl-17-(2,6,6-trimethylcyclohex-1-en-1-yl)heptadeca-2,4,6,8,10,12,14,16-octaenal (2E,4E,6E,8E,10E,12E,14Z,16E)-2,6,11,15-tetramethyl-17-(2,6,6-trimethylcyclohex-1-en-1-yl)heptadeca-2,4,6,8,10,12,14,16-octaenal 1107-26-2 C\C(C=O)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(/C)\C=C\C1=C(C)CCCC1(C)C InChI=1S/C30H40O/c1-24(13-8-9-14-25(2)16-11-18-27(4)23-31)15-10-17-26(3)20-21-29-28(5)19-12-22-30(29,6)7/h8-11,13-18,20-21,23H,12,19,22H2,1-7H3/b9-8+,15-10+,16-11+,21-20+,24-13+,25-14+,26-17-,27-18+ DFMMVLFMMAQXHZ-IPIGPKAOSA-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 homomonocyclic compounds Aldehydes Enals Hydrocarbon derivatives Organic oxides Aldehyde Aliphatic homomonocyclic compound Alpha,beta-unsaturated aldehyde Carbonyl group Enal Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Triterpenoid logp 7.97 ALOGPS logs -5.70 ALOGPS solubility 8.33e-04 g/l ALOGPS melting_point Mp 139° logp 7.6 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac (2E,4E,6E,8E,10E,12E,14Z,16E)-2,6,11,15-tetramethyl-17-(2,6,6-trimethylcyclohex-1-en-1-yl)heptadeca-2,4,6,8,10,12,14,16-octaenal ChemAxon average_mass 416.638 ChemAxon mono_mass 416.307915902 ChemAxon smiles C\C(C=O)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(/C)\C=C\C1=C(C)CCCC1(C)C ChemAxon formula C30H40O ChemAxon inchi InChI=1S/C30H40O/c1-24(13-8-9-14-25(2)16-11-18-27(4)23-31)15-10-17-26(3)20-21-29-28(5)19-12-22-30(29,6)7/h8-11,13-18,20-21,23H,12,19,22H2,1-7H3/b9-8+,15-10+,16-11+,21-20+,24-13+,25-14+,26-17-,27-18+ ChemAxon inchikey DFMMVLFMMAQXHZ-IPIGPKAOSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 146.78 ChemAxon polarizability 53.87 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10800 Specdb::CMs 154962 Specdb::MsMs 289765 Specdb::MsMs 289766 Specdb::MsMs 289767 Specdb::MsMs 329296 Specdb::MsMs 329297 Specdb::MsMs 329298 Specdb::MsMs 2797439 Specdb::MsMs 2797440 Specdb::MsMs 2797441 Specdb::MsMs 2881970 Specdb::MsMs 2881971 Specdb::MsMs 2881972 HMDB36886 #<Reference:0x000055ce325f9820> Citrus Unknown generic Eggs Unknown generic Green vegetables Unknown generic Sweet orange Type 1 specific Citrus sinensis 2711