1.0 2010-04-08 22:10:32 UTC 2019-11-26 03:08:01 UTC FDB013128 Zucchini factor B Constituent of seeds of pumpkin (Cucurbita maxima) and squash (Cucurbita pepo). Zucchini factor B is found in fruits and japanese pumpkin. Zucchini factor B C44H57NO4 663.9277 663.428759317 11-[(benzoyloxy)methyl]-4,4,6b,8a,11,12b,14b-heptamethyl-1,2,3,4,4a,5,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicen-3-yl 4-aminobenzoate 11-[(benzoyloxy)methyl]-4,4,6b,8a,11,12b,14b-heptamethyl-1,2,3,4a,5,7,8,9,10,12,12a,13-dodecahydropicen-3-yl 4-aminobenzoate 246248-10-2 CC1(COC(=O)C2=CC=CC=C2)CCC2(C)CCC3(C)C4=CCC5C(C)(C)C(CCC5(C)C4=CCC3(C)C2C1)OC(=O)C1=CC=C(N)C=C1 InChI=1S/C44H57NO4/c1-39(2)34-18-17-33-32(42(34,5)21-20-36(39)49-38(47)30-13-15-31(45)16-14-30)19-22-44(7)35-27-40(3,23-24-41(35,4)25-26-43(33,44)6)28-48-37(46)29-11-9-8-10-12-29/h8-17,19,34-36H,18,20-28,45H2,1-7H3 VKNUHXUEPNYSDN-UHFFFAOYSA-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 Aromatic homopolycyclic compounds Amino acids and derivatives Aminobenzoic acids and derivatives Aniline and substituted anilines Benzoic acid esters Benzoyl derivatives Carboxylic acid esters Dicarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organooxygen compounds Organopnictogen compounds Primary amines Amine Amino acid or derivatives Aminobenzoic acid or derivatives Aniline or substituted anilines Aromatic homopolycyclic compound Benzenoid Benzoate ester Benzoic acid or derivatives Benzoyl Carboxylic acid derivative Carboxylic acid ester Dicarboxylic acid or derivatives Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary amine Triterpenoid logp 9.26 ALOGPS logs -7.03 ALOGPS solubility 6.15e-05 g/l ALOGPS melting_point Mp 204-206° logp 9.88 ChemAxon pka_strongest_basic 2.8 ChemAxon iupac 11-[(benzoyloxy)methyl]-4,4,6b,8a,11,12b,14b-heptamethyl-1,2,3,4,4a,5,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicen-3-yl 4-aminobenzoate ChemAxon average_mass 663.9277 ChemAxon mono_mass 663.428759317 ChemAxon smiles CC1(COC(=O)C2=CC=CC=C2)CCC2(C)CCC3(C)C4=CCC5C(C)(C)C(CCC5(C)C4=CCC3(C)C2C1)OC(=O)C1=CC=C(N)C=C1 ChemAxon formula C44H57NO4 ChemAxon inchi InChI=1S/C44H57NO4/c1-39(2)34-18-17-33-32(42(34,5)21-20-36(39)49-38(47)30-13-15-31(45)16-14-30)19-22-44(7)35-27-40(3,23-24-41(35,4)25-26-43(33,44)6)28-48-37(46)29-11-9-8-10-12-29/h8-17,19,34-36H,18,20-28,45H2,1-7H3 ChemAxon inchikey VKNUHXUEPNYSDN-UHFFFAOYSA-N ChemAxon polar_surface_area 78.62 ChemAxon refractivity 198.88 ChemAxon polarizability 78.78 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 64422 Specdb::MsMs 64423 Specdb::MsMs 64424 Specdb::MsMs 121566 Specdb::MsMs 121567 Specdb::MsMs 121568 Specdb::MsMs 2325183 Specdb::MsMs 2325184 Specdb::MsMs 2325185 Specdb::MsMs 2609990 Specdb::MsMs 2609991 Specdb::MsMs 2609992 HMDB34610 #<Reference:0x000055ce326f6de0> Fruits Unknown generic Japanese pumpkin Type 1 specific Cucurbita maxima 3661