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
1801 4-(4-Methyl-3-pentenyl)cyclohex-3-ene-1-carbaldehyde CC(=CCCC1=CCC(CC1)C=O)C 37677-14-8 192.30 C13H20O 93199 ZINC5158700 1 5 View
1802 2,3,5-Trithiahexane CSCSSC 42474-44-2 140.29 C3H8S3 93236 ZINC1658755 0 5 View
1803 5-(Methylsulfanyl)pentanenitrile CSCCCCC#N 59121-25-4 129.22 C6H11NS 93320 ZINC6019706 0 2 View
1804 1,1-Diethoxyhex-2-ene CCCC=CC(OCC)OCC 54306-00-2 172.26 C10H20O2 93366 ZINC2539248 0 3 View
1805 2,4-Dimethylcyclohex-3-ene-1-carbaldehyde CC1C=C(CCC1C=O)C 68039-49-6 138.21 C9H14O 93375 ZINC4524376 0 5 View
1806 4-Butyl-5-methylthiazole CCCCC1=C(SC=N1)C 57246-60-3 155.26 C8H13NS 93596 ZINC5831820 0 2 View
1807 5H-3,5a-Epoxynaphth[2,1-c]oxepin, dodecahydro-3,8,8,11a-tetramethyl- CC1(CCCC2(C1CCC34C2CCC(O3)(OC4)C)C)C 57345-19-4 278.43 C18H30O2 93639 ZINC5762258 0 5 View
1808 Benzyl eugenol COC1=C(C=CC(=C1)CC=C)OCC2=CC=CC=C2 57371-42-3 254.32 C17H18O2 93649 ZINC39368 0 5 View
1809 Allyl decanoate CCCCCCCCCC(=O)OCC=C 57856-81-2 212.33 C13H24O2 93831 ZINC2564131 0 4 View
1810 6-Acetoxydihydrotheaspirane CC1CCC2(O1)C(CCCC2(C)OC(=O)C)(C)C 57893-27-3 254.37 C15H26O3 93838 ZINC6031048 0 7 View
1811 Ethyl 2-ethyl-6,6-dimethylcyclohex-2-ene-1-carboxylate CCC1=CCCC(C1C(=O)OCC)(C)C 57934-97-1 210.31 C13H22O2 93847 ZINC2567597 0 8 View
1812 Caryophyllene formate CC1(CC2C1CCC3(CCCC2(C3)OC=O)C)C 58096-46-1 250.38 C16H26O2 93947 ZINC31334485 0 4 View
1813 1,3-Dioxolane, 4-methyl-2-(4-methylphenyl)- CC1COC(O1)C2=CC=C(C=C2)C 58244-29-4 178.23 C11H14O2 94001 ZINC1628412 0 5 View
1814 4-Hexen-1-ol, 5-methyl-2-(1-methylethenyl)- CC(=CCC(CO)C(=C)C)C 58461-27-1 154.25 C10H18O 94060 ZINC1846610 0 4 View
1815 (Ethoxymethoxy)cyclododecane CCOCOC1CCCCCCCCCCC1 58567-11-6 242.40 C15H30O2 94111 ZINC5859128 0 5 View
1816 alpha-Santalene CC(=CCCC1(C2CC3C1(C3C2)C)C)C 512-61-8 204.35 C15H24 94164 ZINC64634147 0 2 View
1817 1,2-Diphenylethanol C1=CC=C(C=C1)CC(C2=CC=CC=C2)O 614-29-9 198.26 C14H14O 94178 ZINC1230350 0 2 View
1818 1-Phenyl-2-propanol CC(CC1=CC=CC=C1)O 698-87-3 136.19 C9H12O 94185 ZINC1684573 0 2 View
1819 1,2-Cyclohexanediol, 1-methyl-4-(1-methylethenyl)- CC(=C)C1CCC(C(C1)O)(C)O 1946-00-5 170.25 C10H18O2 94217 ZINC896806 0 1 View
1820 (-)-trans-Carveol CC1=CCC(CC1O)C(=C)C 1197-07-5 152.23 C10H16O 94221 ZINC967525 0 4 View
1821 Decenoic acid CCCCCCCC=CC(=O)O 3913-85-7 170.25 C10H18O2 94282 ZINC1691018 0 1 View
1822 2-Ethylhexyl benzoate CCCCC(CC)COC(=O)C1=CC=CC=C1 5444-75-7 234.33 C15H22O2 94310 ZINC1562393 0 1 View
1823 Di-sec-butyl disulfide CCC(C)SSC(C)CC 5943-30-6 178.36 C8H18S2 94314 ZINC2534772 0 1 View
1824 Propylene glycol dicaprylate CCCCCCCC(=O)OCC(C)OC(=O)CCCCCCC 7384-98-7 328.49 C19H36O4 94339 ZINC98084545 0 2 View
1825 Isomintlactone CC1CCC2=C(C(=O)OC2C1)C 13341-72-5 166.22 C10H14O2 94349 ZINC6030766  0 7 View
Showing 1801 to 1825 of total 3985 entries