1.0 2010-04-08 22:14:13 UTC 2019-11-26 03:17:16 UTC FDB019232 Repandiol Constituent of the edible mushrooms Hydnum repandum and Hydnum repandum variety album. Repandiol is found in mushrooms. 2,3,8,9-Diepoxy-4,6-decadiyne-1,10-diol Repandiol C10H10O4 194.184 194.057908808 (3-{4-[3-(hydroxymethyl)oxiran-2-yl]buta-1,3-diyn-1-yl}oxiran-2-yl)methanol (3-{4-[3-(hydroxymethyl)oxiran-2-yl]buta-1,3-diyn-1-yl}oxiran-2-yl)methanol 147921-90-2 OCC1OC1C#CC#CC1OC1CO InChI=1S/C10H10O4/c11-5-9-7(13-9)3-1-2-4-8-10(6-12)14-8/h7-12H,5-6H2 BQWDCZPSFPXRCB-UHFFFAOYSA-N belongs to the class of organic compounds known as epoxides. Epoxides are compounds containing a cyclic ether with three ring atoms(one oxygen and two carbon atoms). Epoxides Organic compounds Organoheterocyclic compounds Epoxides Aliphatic heteromonocyclic compounds Dialkyl ethers Hydrocarbon derivatives Oxacyclic compounds Primary alcohols Alcohol Aliphatic heteromonocyclic compound Dialkyl ether Ether Hydrocarbon derivative Organic oxygen compound Organooxygen compound Oxacycle Oxirane Primary alcohol logp -0.50 ALOGPS logs -2.49 ALOGPS solubility 6.35e-01 g/l ALOGPS melting_point Mp 168-169° logp -0.46 ChemAxon pka_strongest_acidic 14.26 ChemAxon pka_strongest_basic -3 ChemAxon iupac (3-{4-[3-(hydroxymethyl)oxiran-2-yl]buta-1,3-diyn-1-yl}oxiran-2-yl)methanol ChemAxon average_mass 194.184 ChemAxon mono_mass 194.057908808 ChemAxon smiles OCC1OC1C#CC#CC1OC1CO ChemAxon formula C10H10O4 ChemAxon inchi InChI=1S/C10H10O4/c11-5-9-7(13-9)3-1-2-4-8-10(6-12)14-8/h7-12H,5-6H2 ChemAxon inchikey BQWDCZPSFPXRCB-UHFFFAOYSA-N ChemAxon polar_surface_area 65.52 ChemAxon refractivity 48.51 ChemAxon polarizability 20.3 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20038 Specdb::CMs 46480 Specdb::CMs 132928 Specdb::CMs 140662 Specdb::NmrOneD 33962 Specdb::NmrOneD 33963 Specdb::NmrOneD 33964 Specdb::NmrOneD 33965 Specdb::NmrOneD 33966 Specdb::NmrOneD 33967 Specdb::NmrOneD 33968 Specdb::NmrOneD 33969 Specdb::NmrOneD 33970 Specdb::NmrOneD 33971 Specdb::NmrOneD 33972 Specdb::NmrOneD 33973 Specdb::NmrOneD 33974 Specdb::NmrOneD 33975 Specdb::NmrOneD 33976 Specdb::NmrOneD 33977 Specdb::NmrOneD 33978 Specdb::NmrOneD 33979 Specdb::NmrOneD 33980 Specdb::NmrOneD 33981 Specdb::MsMs 8897 Specdb::MsMs 8898 Specdb::MsMs 8899 Specdb::MsMs 15569 Specdb::MsMs 15570 Specdb::MsMs 15571 Specdb::MsMs 2429524 Specdb::MsMs 2429525 Specdb::MsMs 2429526 Specdb::MsMs 2505803 Specdb::MsMs 2505804 Specdb::MsMs 2505805 HMDB39606 #<Reference:0x000055ce33379e00> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322