Odorants & Odorless Compounds

Odorants are volatile and largely hydrophobic organic compounds possessing odors while odorless compounds are chemicals which do not possess or are associated with any odor. OlfactionBase comprises of 3985 odorant molecules representing an array of odors and 1124 odorless compounds. Odorant molecules are classified by 30 functional groups such as (acid, alcohol, aldehyde, alkane, cyclic, ether, ester, ketone, thiol, etc.). Each molecule entry includes detail information about physicochemical properties, odor profile, pharmacokinetic profile and drug likeness and cross-references to other biological databases. Among 3985 odorant molecules, 197 molecules are associated with 156 Olfactory receptors belonging to two species (Human and Mus musculus). The user-friendly interface of Olfactionbase facilitates exploration of chemicals in various ways: search chemical compounds with CAS No., odor and sub-odors, functional group, SMILES notation and molecular weight.

 

 

Sr.No. Name SMILES CAS No Mol. Wt. Mol. Formula PubChem ZINC #OR's #Odors Details
1951 2-Ethoxy-4-(4,4,6-trimethyl-1,3-dioxan-2-yl)phenol CCOC1=C(C=CC(=C1)C2OC(CC(O2)(C)C)C)O 52514-67-7 266.33 C15H22O4 103655 ZINC5863157 0 4 View
1952 Methylcamphenoate CC1(CC2CC(C1C2)C(=O)OC)C 52557-97-8 182.26 C11H18O2 103659 ZINC5762510 0 7 View
1953 Ethyl 3-p-tolyloxirane-2-carboxylate CCOC(=O)C1C(O1)C2=CC=C(C=C2)C 52788-71-3 206.24 C12H14O3 103688 ZINC5857058 0 5 View
1954 4,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5-methoxy- COC1CC2CC1C3C2CC=C3 53018-24-9 164.24 C11H16O 103719 ZINC2545278 0 5 View
1955 3-(Methylthio)-2-butanone CC(C(=O)C)SC 53475-15-3 118.20 C5H10OS 103788 ZINC2568012 0 9 View
1956 2,6-Dimethyloct-7-en-2-yl acetate CC(CCCC(C)(C)OC(=O)C)C=C 53767-93-4 198.30 C12H22O2 103826 ZINC6020540 0 4 View
1957 3-Methyl-5-phenylpentanenitrile CC(CCC1=CC=CC=C1)CC#N 54089-83-7 173.25 C12H15N 103875 ZINC6020673 0 6 View
1958 Undecane, 1,1-dimethoxy- CCCCCCCCCCC(OC)OC 52517-67-6 216.36 C13H28O2 104224 ZINC2168244 0 3 View
1959 6-Methylheptanal CC(C)CCCCC=O 63885-09-6 128.21 C8H16O 104307 ZINC5757935 0 5 View
1960 2-Ethoxy-6-methylpyrazine CCOC1=NC(=CN=C1)C 53163-97-6 138.17 C7H10N2O 104421 ZINC5863713 0 2 View
1961 1,3-Dioxepin, 4,7-dihydro-2-methyl-2-(3-methylbutyl)- CC(C)CCC1(OCC=CCO1)C 53338-05-9 184.28 C11H20O2 104471 ZINC5373374 0 5 View
1962 Acetaldehyde, (octyloxy)- CCCCCCCCOCC=O 53488-14-5 172.26 C10H20O2 104512 ZINC2384618 0 3 View
1963 2-Isobutyl-4,5-dimethylthiazole CC1=C(SC(=N1)CC(C)C)C 53498-32-1 169.29 C9H15NS 104513 ZINC2510294 0 10 View
1964 Veratryl acetate CC(=O)OCC1=CC(=C(C=C1)OC)OC 53751-40-9 210.23 C11H14O4 104598 ZINC5166219 0 5 View
1965 4,5-Dimethyl-2-propyloxazole CCCC1=NC(=C(O1)C)C 53833-32-2 139.19 C8H13NO 104620 ZINC5844826 0 2 View
1966 2-Acetyl-3,5-dimethylpyrazine CC1=CN=C(C(=N1)C)C(=O)C 54300-08-2 150.18 C8H10N2O 104721 ZINC2516010  0 4 View
1967 2-Acetyl-3,6-dimethylpyrazine CC1=CN=C(C(=N1)C(=O)C)C 54300-09-3 150.18 C8H10N2O 104722 ZINC2516013 0 4 View
1968 o-(Ethoxymethyl)anisole CCOCC1=CC=CC=C1OC 64988-06-3 166.22 C10H14O2 105179 ZINC5859354 0 5 View
1969 3-(3-Butenyl)-2,4,4-trimethylcyclohex-2-en-1-one CC1=C(C(CCC1=O)(C)C)CCC=C 67401-27-8 192.30 C13H20O 105426 ZINC5766361 0 4 View
1970 3-(4-Ethylphenyl)-2,2-dimethylpropanal CCC1=CC=C(C=C1)CC(C)(C)C=O 67634-15-5 190.28 C13H18O 105513 ZINC1252236 3 5 View
1971 2-Phenylethyl pivalate CC(C)(C)C(=O)OCCC1=CC=CC=C1 67662-96-8 206.28 C13H18O2 105516 ZINC2575100 0 5 View
1972 Benzoic acid, 2-[(2-phenylethylidene)amino]-, methyl ester COC(=O)C1=CC=CC=C1N=CCC2=CC=CC=C2 67785-76-6 253.30 C16H15NO2 105594 ZINC5997553 0 8 View
1973 Benzylisopropyl propionate CCC(=O)OC(C)(C)CC1=CC=CC=C1 67785-77-7 206.28 C13H18O2 105595 ZINC2559021 0 6 View
1974 Methyl 2-(octylideneamino)benzoate CCCCCCCC=NC1=CC=CC=C1C(=O)OC 67801-44-9 261.36 C16H23NO2 105651 ZINC100296921 0 6 View
1975 2-Tert-Butylcyclohexyl ethyl carbonate CCOC(=O)OC1CCCCC1C(C)(C)C 67801-64-3 228.33 C13H24O3 105664 ZINC5856381 0 5 View
Showing 1951 to 1975 of total 3985 entries