1.0 2010-04-08 22:12:03 UTC 2025-11-19 00:59:22 UTC FDB015785 18-Deoxysagittarol Constituent of Sagittaria sagittifolia (arrowhead). 18-Deoxysagittarol is found in root vegetables. 18-Deoxysagittarol C20H34O 290.4834 290.26096571 5-(1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl)-3-methylpent-1-en-3-ol 5-(1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-1-en-3-ol CC1CCC2(C)C(CCC=C2C)C1(C)CCC(C)(O)C=C InChI=1S/C20H34O/c1-7-18(4,21)13-14-20(6)16(3)11-12-19(5)15(2)9-8-10-17(19)20/h7,9,16-17,21H,1,8,10-14H2,2-6H3 YBDUXZKWDIUNSG-UHFFFAOYSA-N belongs to the class of organic compounds known as colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations. Colensane and clerodane diterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Diterpenoids Aliphatic homopolycyclic compounds Hydrocarbon derivatives Tertiary alcohols Alcohol Aliphatic homopolycyclic compound Clerodane diterpenoid Hydrocarbon derivative Organic oxygen compound Organooxygen compound Tertiary alcohol logp 5.79 ALOGPS logs -5.71 ALOGPS solubility 5.60e-04 g/l ALOGPS logp 5.25 ChemAxon pka_strongest_acidic 18.2 ChemAxon pka_strongest_basic -1.4 ChemAxon iupac 5-(1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-yl)-3-methylpent-1-en-3-ol ChemAxon average_mass 290.4834 ChemAxon mono_mass 290.26096571 ChemAxon smiles CC1CCC2(C)C(CCC=C2C)C1(C)CCC(C)(O)C=C ChemAxon formula C20H34O ChemAxon inchi InChI=1S/C20H34O/c1-7-18(4,21)13-14-20(6)16(3)11-12-19(5)15(2)9-8-10-17(19)20/h7,9,16-17,21H,1,8,10-14H2,2-6H3 ChemAxon inchikey YBDUXZKWDIUNSG-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 92.15 ChemAxon polarizability 36.18 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 8333 Specdb::MsMs 8334 Specdb::MsMs 8335 Specdb::MsMs 15005 Specdb::MsMs 15006 Specdb::MsMs 15007 Specdb::MsMs 2409304 Specdb::MsMs 2409305 Specdb::MsMs 2409306 Specdb::MsMs 2553064 Specdb::MsMs 2553065 Specdb::MsMs 2553066 Specdb::CMs 18147 Specdb::CMs 45063 Specdb::CMs 160385 HMDB36834 #<Reference:0x000055ce3160c3b8> Root vegetables Unknown generic