1.0 2010-04-08 22:10:16 UTC 2025-11-18 23:38:17 UTC FDB012618 Egonol gentiobioside Production by Laetiporus sulphureus variety miniatus. Egonol gentiobioside is found in mushrooms. Egonol gentiobioside C31H38O15 650.6244 650.221070546 2-{3-[2-(2H-1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy}-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triol 2-{3-[2-(2H-1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy}-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triol 530-22-3 COC1=CC(CCCOC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)=CC2=C1OC(=C2)C1=CC2=C(OCO2)C=C1 InChI=1S/C31H38O15/c1-39-20-8-14(7-16-10-18(44-29(16)20)15-4-5-17-19(9-15)43-13-42-17)3-2-6-40-30-27(37)26(36)24(34)22(46-30)12-41-31-28(38)25(35)23(33)21(11-32)45-31/h4-5,7-10,21-28,30-38H,2-3,6,11-13H2,1H3 NBGJGWFIDMDCAW-UHFFFAOYSA-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 Acetals Alkyl aryl ethers Alkyl glycosides Anisoles Benzodioxoles Benzofurans Disaccharides Fatty acyl glycosides of mono- and disaccharides Furans Heteroaromatic compounds Hydrocarbon derivatives Lignan glycosides O-glycosyl compounds Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols 2-arylbenzofuran flavonoid Acetal Alcohol Alkyl aryl ether Alkyl glycoside Anisole Aromatic heteropolycyclic compound Benzenoid Benzodioxole Benzofuran Disaccharide Ether Fatty acyl Fatty acyl glycoside Fatty acyl glycoside of mono- or disaccharide Furan Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Lignan glycoside Neolignan skeleton O-glycosyl compound Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol logp 0.35 ALOGPS logs -2.83 ALOGPS solubility 9.52e-01 g/l ALOGPS melting_point Mp 147-149° (hepta-Ac) logp -0.41 ChemAxon pka_strongest_acidic 11.91 ChemAxon pka_strongest_basic -3 ChemAxon iupac 2-{3-[2-(2H-1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propoxy}-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triol ChemAxon average_mass 650.6244 ChemAxon mono_mass 650.221070546 ChemAxon smiles COC1=CC(CCCOC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)=CC2=C1OC(=C2)C1=CC2=C(OCO2)C=C1 ChemAxon formula C31H38O15 ChemAxon inchi InChI=1S/C31H38O15/c1-39-20-8-14(7-16-10-18(44-29(16)20)15-4-5-17-19(9-15)43-13-42-17)3-2-6-40-30-27(37)26(36)24(34)22(46-30)12-41-31-28(38)25(35)23(33)21(11-32)45-31/h4-5,7-10,21-28,30-38H,2-3,6,11-13H2,1H3 ChemAxon inchikey NBGJGWFIDMDCAW-UHFFFAOYSA-N ChemAxon polar_surface_area 219.36 ChemAxon refractivity 153.14 ChemAxon polarizability 67.67 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 14 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 125518 Specdb::NmrOneD 125519 Specdb::NmrOneD 125520 Specdb::NmrOneD 125521 Specdb::NmrOneD 125522 Specdb::NmrOneD 125523 Specdb::NmrOneD 125524 Specdb::NmrOneD 125525 Specdb::NmrOneD 125526 Specdb::NmrOneD 125527 Specdb::NmrOneD 125528 Specdb::NmrOneD 125529 Specdb::NmrOneD 125530 Specdb::NmrOneD 125531 Specdb::NmrOneD 125532 Specdb::NmrOneD 125533 Specdb::NmrOneD 125534 Specdb::NmrOneD 125535 Specdb::NmrOneD 125536 Specdb::NmrOneD 125537 Specdb::MsMs 60126 Specdb::MsMs 60127 Specdb::MsMs 60128 Specdb::MsMs 116400 Specdb::MsMs 116401 Specdb::MsMs 116402 Specdb::MsMs 2320601 Specdb::MsMs 2320602 Specdb::MsMs 2320603 Specdb::MsMs 2618897 Specdb::MsMs 2618898 Specdb::MsMs 2618899 Specdb::CMs 25469 Specdb::CMs 643702 Specdb::CMs 643703 Specdb::CMs 643704 Specdb::CMs 643705 Specdb::CMs 643706 Specdb::CMs 643707 Specdb::CMs 643708 Specdb::CMs 643709 Specdb::CMs 643710 Specdb::CMs 643711 Specdb::CMs 643712 Specdb::CMs 643713 Specdb::CMs 643714 Specdb::CMs 643715 Specdb::CMs 643716 Specdb::CMs 643717 Specdb::CMs 643718 Specdb::CMs 643719 Specdb::CMs 643720 Specdb::CMs 643721 Specdb::CMs 643722 Specdb::CMs 643723 Specdb::CMs 643724 Specdb::CMs 643725 HMDB34281 #<Reference:0x000055ce31e37c18> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322