1.0 2010-04-08 22:05:33 UTC 2025-11-18 22:41:17 UTC FDB002860 Momordicilin Constituent of Momordica charantia (bitter melon). Momordicilin is found in fruits. Momordicilin C36H60O3 540.8598 540.454245786 4-({[(3E)-2-hydroxyhex-3-en-2-yl]oxy}methyl)-4,6a,6b,8a,11,12,14b-heptamethyl-docosahydropicen-3-one 4-({[(3E)-2-hydroxyhex-3-en-2-yl]oxy}methyl)-4,6a,6b,8a,11,12,14b-heptamethyl-hexadecahydropicen-3-one 189156-40-9 CC\C=C\C(C)(O)OCC1(C)C2CCC3(C)C(CCC4C5C(C)C(C)CCC5(C)CCC34C)C2(C)CCC1=O InChI=1S/C36H60O3/c1-10-11-17-36(9,38)39-23-33(6)27-15-20-35(8)28(32(27,5)19-16-29(33)37)13-12-26-30-25(3)24(2)14-18-31(30,4)21-22-34(26,35)7/h11,17,24-28,30,38H,10,12-16,18-23H2,1-9H3/b17-11+ UQBFECUQCTWGFC-GZTJUZNOSA-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 homopolycyclic compounds Cyclic ketones Hemiketals Hydrocarbon derivatives Organic oxides Steroids and steroid derivatives Aliphatic homopolycyclic compound Carbonyl group Cyclic ketone Hemiacetal Hemiketal Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Steroid Triterpenoid logp 6.82 ALOGPS logs -7.78 ALOGPS solubility 9.00e-06 g/l ALOGPS melting_point Mp 170-171° logp 9.17 ChemAxon pka_strongest_acidic 11.96 ChemAxon pka_strongest_basic -4.1 ChemAxon iupac 4-({[(3E)-2-hydroxyhex-3-en-2-yl]oxy}methyl)-4,6a,6b,8a,11,12,14b-heptamethyl-docosahydropicen-3-one ChemAxon average_mass 540.8598 ChemAxon mono_mass 540.454245786 ChemAxon smiles CC\C=C\C(C)(O)OCC1(C)C2CCC3(C)C(CCC4C5C(C)C(C)CCC5(C)CCC34C)C2(C)CCC1=O ChemAxon formula C36H60O3 ChemAxon inchi InChI=1S/C36H60O3/c1-10-11-17-36(9,38)39-23-33(6)27-15-20-35(8)28(32(27,5)19-16-29(33)37)13-12-26-30-25(3)24(2)14-18-31(30,4)21-22-34(26,35)7/h11,17,24-28,30,38H,10,12-16,18-23H2,1-9H3/b17-11+ ChemAxon inchikey UQBFECUQCTWGFC-GZTJUZNOSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 162.32 ChemAxon polarizability 67.64 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15217 Specdb::CMs 42242 Specdb::CMs 265276 Specdb::CMs 265277 Specdb::CMs 265278 Specdb::CMs 281344 Specdb::MsMs 93375 Specdb::MsMs 93376 Specdb::MsMs 93377 Specdb::MsMs 157125 Specdb::MsMs 157126 Specdb::MsMs 157127 Specdb::MsMs 2763310 Specdb::MsMs 2763311 Specdb::MsMs 2763312 Specdb::MsMs 2942206 Specdb::MsMs 2942207 Specdb::MsMs 2942208 HMDB30896 #<Reference:0x000055ce31bfb710> Fruits Unknown generic