1.0 2010-04-08 22:09:35 UTC 2019-11-26 03:04:50 UTC FDB011346 Licarin C Isolated from nutmeg. Licarin C is found in herbs and spices. (+)(-)-trans-dehydrodIIsoeugenol Licarin a Licarin C C22H26O5 370.4388 370.178023942 7-methoxy-3-methyl-5-[(1Z)-prop-1-en-1-yl]-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran 7-methoxy-3-methyl-5-[(1Z)-prop-1-en-1-yl]-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran 60297-83-8 COC1=CC(\C=C/C)=CC2=C1OC(C2C)C1=CC(OC)=C(OC)C(OC)=C1 InChI=1S/C22H26O5/c1-7-8-14-9-16-13(2)20(27-21(16)17(10-14)23-3)15-11-18(24-4)22(26-6)19(12-15)25-5/h7-13,20H,1-6H3/b8-7- GPTWTKZDAAYJRN-FPLPWBNLSA-N belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety. 2-arylbenzofuran flavonoids Organic compounds Phenylpropanoids and polyketides 2-arylbenzofuran flavonoids Aromatic heteropolycyclic compounds Alkyl aryl ethers Anisoles Benzofurans Coumarans Hydrocarbon derivatives Lignans, neolignans and related compounds Methoxybenzenes Oxacyclic compounds Phenoxy compounds Styrenes 2-arylbenzofuran flavonoid Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzofuran Coumaran Ether Hydrocarbon derivative Methoxybenzene Monocyclic benzene moiety Neolignan skeleton Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol ether Phenoxy compound Styrene logp 4.87 ALOGPS logs -5.78 ALOGPS solubility 6.15e-04 g/l ALOGPS melting_point Mp 100-101° logp 4.5 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac 7-methoxy-3-methyl-5-[(1Z)-prop-1-en-1-yl]-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran ChemAxon average_mass 370.4388 ChemAxon mono_mass 370.178023942 ChemAxon smiles COC1=CC(\C=C/C)=CC2=C1OC(C2C)C1=CC(OC)=C(OC)C(OC)=C1 ChemAxon formula C22H26O5 ChemAxon inchi InChI=1S/C22H26O5/c1-7-8-14-9-16-13(2)20(27-21(16)17(10-14)23-3)15-11-18(24-4)22(26-6)19(12-15)25-5/h7-13,20H,1-6H3/b8-7- ChemAxon inchikey GPTWTKZDAAYJRN-FPLPWBNLSA-N ChemAxon polar_surface_area 46.15 ChemAxon refractivity 105.8 ChemAxon polarizability 41.29 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 5 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21423 Specdb::CMs 166671 Specdb::MsMs 44973 Specdb::MsMs 44974 Specdb::MsMs 44975 Specdb::MsMs 124344 Specdb::MsMs 124345 Specdb::MsMs 124346 Specdb::MsMs 2431600 Specdb::MsMs 2431601 Specdb::MsMs 2431602 Specdb::MsMs 2508121 Specdb::MsMs 2508122 Specdb::MsMs 2508123 HMDB33319 #<Reference:0x000055ce31f244a0> Herbs and Spices Unknown generic