1.0 2010-04-08 22:15:12 UTC 2019-11-26 03:19:18 UTC FDB020692 O-Geranylvanillin Constituent of rock samphire (Crithmum maritimum). O-Geranylvanillin is found in green vegetables. O-Geranylvanillin C18H24O3 288.3814 288.172544634 4-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-3-methoxybenzaldehyde 4-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-3-methoxybenzaldehyde 151455-08-2 COC1=C(OC\C=C(/C)CCC=C(C)C)C=CC(C=O)=C1 InChI=1S/C18H24O3/c1-14(2)6-5-7-15(3)10-11-21-17-9-8-16(13-19)12-18(17)20-4/h6,8-10,12-13H,5,7,11H2,1-4H3/b15-10+ SRLAFDUAEAXGBA-XNTDXEJSSA-N belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring. Aromatic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aromatic homomonocyclic compounds Alkyl aryl ethers Anisoles Benzaldehydes Benzoyl derivatives Hydrocarbon derivatives Methoxybenzenes Monocyclic monoterpenoids Organic oxides Phenoxy compounds Aldehyde Alkyl aryl ether Anisole Aromatic homomonocyclic compound Aromatic monoterpenoid Aryl-aldehyde Benzaldehyde Benzenoid Benzoyl Ether Hydrocarbon derivative Methoxybenzene Monocyclic benzene moiety Monocyclic monoterpenoid Organic oxide Organic oxygen compound Organooxygen compound Phenol ether Phenoxy compound logp 4.53 ALOGPS logs -5.00 ALOGPS solubility 2.92e-03 g/l ALOGPS logp 4.39 ChemAxon pka_strongest_basic -4.6 ChemAxon iupac 4-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-3-methoxybenzaldehyde ChemAxon average_mass 288.3814 ChemAxon mono_mass 288.172544634 ChemAxon smiles COC1=C(OC\C=C(/C)CCC=C(C)C)C=CC(C=O)=C1 ChemAxon formula C18H24O3 ChemAxon inchi InChI=1S/C18H24O3/c1-14(2)6-5-7-15(3)10-11-21-17-9-8-16(13-19)12-18(17)20-4/h6,8-10,12-13H,5,7,11H2,1-4H3/b15-10+ ChemAxon inchikey SRLAFDUAEAXGBA-XNTDXEJSSA-N ChemAxon polar_surface_area 35.53 ChemAxon refractivity 88.49 ChemAxon polarizability 33.72 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10269 Specdb::CMs 165883 Specdb::MsMs 288655 Specdb::MsMs 288656 Specdb::MsMs 288657 Specdb::MsMs 327844 Specdb::MsMs 327845 Specdb::MsMs 327846 Specdb::MsMs 2757789 Specdb::MsMs 2757790 Specdb::MsMs 2757791 Specdb::MsMs 2948082 Specdb::MsMs 2948083 Specdb::MsMs 2948084 HMDB40864 #<Reference:0x000055ce33387e38> Green vegetables Unknown generic