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
1726 Nonanal, 2-(phenylmethylene)- CCCCCCCC(=CC1=CC=CC=C1)C=O 20175-19-3 230.35 C16H22O 89284 ZINC59544097 0 3 View
1727 Isobornyl propionate CCC(=O)OC1CC2CCC1(C2(C)C)C 2756-56-1 210.31 C13H22O2 89306 ZINC4723089 0 9 View
1728 3-Octyl butyrate CCCCCC(CC)OC(=O)CCC 20286-45-7 200.32 C12H24O2 89307 ZINC5513256 0 7 View
1729 2-Butenoic acid, 3-methyl-, 3,7-dimethyl-6-octenyl ester CC(CCC=C(C)C)CCOC(=O)C=C(C)C 20770-40-5 238.37 C15H26O2 89382 ZINC2534724 0 3 View
1730 3,7-Dimethyloctan-3-yl acetate CCC(C)(CCCC(C)C)OC(=O)C 20780-48-7 200.32 C12H24O2 89385 ZINC2563398 0 8 View
1731 Tonalid CC1CC(C2=C(C1(C)C)C=C(C(=C2)C(=O)C)C)(C)C 21145-77-7 258.40 C18H26O 89440 ZINC1323080 0 6 View
1732 3,8a-Ethano-8aH-1-benzopyran-2(3H)-one, hexahydro-3,5,5-trimethyl- CC1(CCCC23C1CC(CC2)(C(=O)O3)C)C 21280-29-5 222.32 C14H22O2 89479 ZINC5454435 0 5 View
1733 2-Cyclopenten-1-one, 2-hydroxy-3,4-dimethyl- CC1CC(=O)C(=C1C)O 21835-00-7 126.15 C7H10O2 89539 ZINC5735548 0 1 View
1734 2-Nonenoic acid gamma-lactone CCCCCC1C=CC(=O)O1 21963-26-8 154.21 C9H14O2 89559 ZINC5513289 0 5 View
1735 1-Nonen-3-ol CCCCCCC(C=C)O 21964-44-3 142.24 C9H18O 89560 ZINC1680040 0 6 View
1736 3,7-Dimethyloct-6-enal oxime CC(CCC=C(C)C)CC=NO 22457-25-6 169.26 C10H19NO 89723 ZINC5734925 0 3 View
1737 Methyl 5-methylsalicylate CC1=CC(=C(C=C1)O)C(=O)OC 22717-57-3 166.17 C9H10O3 89802 ZINC162965 0 4 View
1738 2-Phenoxyethyl butyrate CCCC(=O)OCCOC1=CC=CC=C1 23511-70-8 208.25 C12H16O3 90136 ZINC1596143 0 6 View
1739 S-Methyl 3-methylbutanethioate CC(C)CC(=O)SC 23747-45-7 132.22 C6H12OS 90246 ZINC5360197 0 12 View
1740 cis-3-Ethoxy-1,1,5-trimethylcyclohexane CCOC1CC(CC(C1)(C)C)C 24691-15-4 170.29 C11H22O 90586 ZINC5860951 0 6 View
1741 2-Butenoic acid, 2-methyl-, 3,7-dimethyl-6-octenyl ester, (2E)- CC=C(C)C(=O)OCCC(C)CCC=C(C)C 255714-11-5 238.37 C15H26O2 90592 ZINC2384576 0 2 View
1742 3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, 2-acetate CC1=C(C(CCC1)(C)C)C=CC(C)OC(=O)C 22030-19-9 236.35 C15H24O2 90720 ZINC5191516 0 9 View
1743 2-Dodecen-1-ol CCCCCCCCCC=CCO 22104-81-0 184.32 C12H24O 90733 ZINC2560461 0 1 View
1744 2-Methylene-3,5,5-trimethylhexanal CC(CC(C)(C)C)C(=C)C=O 22414-70-6 154.25 C10H18O 90773 ZINC6020389 0 2 View
1745 3,7-Dimethyl-2-methyleneocta-6-enal CC(CCC=C(C)C)C(=C)C=O 22418-66-2 166.26 C11H18O 90776 ZINC2559065 0 6 View
1746 Bulnesol CC1CCC2=C(CCC(CC12)C(C)(C)O)C 22451-73-6 222.37 C15H26O 90785 ZINC6030775 0 1 View
1747 5-Methylheptan-3-one oxime CCC(C)CC(=NO)CC 22457-23-4 143.23 C8H17NO 90787 ZINC14591955 0 6 View
1748 3,7-Dimethyloct-7-ene-1,6-diol CC(CCC(C(=C)C)O)CCO 22460-95-3 172.26 C10H20O2 90790 ZINC6020646 0 2 View
1749 2-Tridecenenitrile CCCCCCCCCCC=CC#N 22629-49-8 193.33 C13H23N 90818 ZINC2534717 0 6 View
1750 Octane, 1-ethoxy-3,7-dimethyl- CCOCCC(C)CCCC(C)C 22810-10-2 186.33 C12H26O 90843 ZINC5859098 0 7 View
Showing 1726 to 1750 of total 3985 entries