1.0 2010-04-08 22:12:08 UTC 2019-11-26 03:12:28 UTC FDB015944 Muricin G Constituent of the seeds of Annona muricata (soursop). Muricin G is found in fruits. C35H62O7 594.8626 594.449554338 5-methyl-3-(2,8,13-trihydroxy-13-{5-[(4Z)-1-hydroxytridec-4-en-1-yl]oxolan-2-yl}tridecyl)-2,5-dihydrofuran-2-one 5-methyl-3-(2,8,13-trihydroxy-13-{5-[(4Z)-1-hydroxytridec-4-en-1-yl]oxolan-2-yl}tridecyl)-5H-furan-2-one CCCCCCCC\C=C/CCC(O)C1CCC(O1)C(O)CCCCC(O)CCCCCC(O)CC1=CC(C)OC1=O InChI=1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(36)18-13-12-14-20-30(37)26-28-25-27(2)41-35(28)40/h10-11,25,27,29-34,36-39H,3-9,12-24,26H2,1-2H3/b11-10- CYINDKRPEUGVGU-KHPPLWFESA-N belongs to the class of organic compounds known as annonaceous acetogenins. These are waxy derivatives of fatty acids (usually C32 or C34), containing a terminal carboxylic acid combined with a 2-propanol unit at the C-2 position to form a methyl- substituted alpha,beta-unsaturated-gamma-lactone. One of their interesting structural features is a single, adjacent, or nonadjacent tetrahydrofuran (THF) or tetrahydropyran (THP) system with one or two flanking hydroxyl group(s) at the center of a long hydrocarbon chain. Annonaceous acetogenins Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohols Aliphatic heteromonocyclic compounds Butenolides Carbonyl compounds Dialkyl ethers Enoate esters Hydrocarbon derivatives Lactones Long-chain fatty alcohols Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Polyols Secondary alcohols Tetrahydrofurans 2-furanone Alcohol Aliphatic heteromonocyclic compound Alpha,beta-unsaturated carboxylic ester Annonaceae acetogenin skeleton Carbonyl group Carboxylic acid derivative Carboxylic acid ester Dialkyl ether Dihydrofuran Enoate ester Ether Hydrocarbon derivative Lactone Long chain fatty alcohol Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Polyol Secondary alcohol Tetrahydrofuran logp 6.28 ALOGPS logs -5.55 ALOGPS solubility 1.69e-03 g/l ALOGPS logp 7.34 ChemAxon pka_strongest_acidic 13.85 ChemAxon pka_strongest_basic -1.3 ChemAxon iupac 5-methyl-3-(2,8,13-trihydroxy-13-{5-[(4Z)-1-hydroxytridec-4-en-1-yl]oxolan-2-yl}tridecyl)-2,5-dihydrofuran-2-one ChemAxon average_mass 594.8626 ChemAxon mono_mass 594.449554338 ChemAxon smiles CCCCCCCC\C=C/CCC(O)C1CCC(O1)C(O)CCCCC(O)CCCCCC(O)CC1=CC(C)OC1=O ChemAxon formula C35H62O7 ChemAxon inchi InChI=1S/C35H62O7/c1-3-4-5-6-7-8-9-10-11-15-21-31(38)33-23-24-34(42-33)32(39)22-17-16-19-29(36)18-13-12-14-20-30(37)26-28-25-27(2)41-35(28)40/h10-11,25,27,29-34,36-39H,3-9,12-24,26H2,1-2H3/b11-10- ChemAxon inchikey CYINDKRPEUGVGU-KHPPLWFESA-N ChemAxon polar_surface_area 116.45 ChemAxon refractivity 170.46 ChemAxon polarizability 72.43 ChemAxon rotatable_bond_count 25 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 93327 Specdb::MsMs 93328 Specdb::MsMs 93329 Specdb::MsMs 157071 Specdb::MsMs 157072 Specdb::MsMs 157073 Specdb::MsMs 2678518 Specdb::MsMs 2678519 Specdb::MsMs 2678520 Specdb::MsMs 3030194 Specdb::MsMs 3030195 Specdb::MsMs 3030196 Specdb::CMs 10822 Specdb::CMs 45150 Specdb::CMs 283018 Specdb::CMs 444303 Specdb::CMs 444304 Specdb::CMs 444305 Specdb::CMs 444306 Specdb::CMs 444307 Specdb::CMs 444308 Specdb::CMs 444309 Specdb::CMs 444310 Specdb::CMs 444311 Specdb::CMs 444312 Specdb::CMs 444313 Specdb::CMs 444314 Specdb::CMs 444315 Specdb::CMs 444316 Specdb::CMs 444317 Specdb::CMs 444318 Specdb::CMs 444319 Specdb::CMs 444320 Specdb::CMs 444321 Specdb::CMs 444322 Specdb::CMs 444323 Specdb::CMs 444324 HMDB36973 #<Reference:0x000055ce3188f4f0> Fruits Unknown generic