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
2326 3,5-Octadiene-2-one CCC=CC=CC(=O)C 4173-41-5 124.18 C8H12O 181575 ZINC33950244 0 5 View
2327 Cycloheptanol, 2,2,7,7-tetramethyl-1-(2-propenyl)- CC1(CCCCC(C1(CC=C)O)(C)C)C 105463-44-3 210.36 C14H26O 184493 ZINC5762244 0 6 View
2328 5-Hexenyl isothiocyanate C=CCCCCN=C=S 49776-81-0 141.23 C7H11NS 184852 ZINC5157719  0 4 View
2329 ((4-Methoxybenzoyl)oxy)acetic acid COC1=CC=C(C=C1)C(=O)OCC(=O)O 10414-68-3 210.18 C10H10O5 193458 ZINC1757539 0 3 View
2330 Diacetyl trimer CC(=O)C1(CC2(C(O1)(OC(O2)(C)C(=O)C)C)O)C 18114-49-3 258.27 C12H18O6 193527 ZINC3650145 0 2 View
2331 6,6,9a-Trimethyl-1,2,3a,4,5,5a,7,8,9,9b-decahydrobenzo[e][1]benzofuran CC1(CCCC2(C1CCC3C2CCO3)C)C 65588-69-4 222.37 C15H26O 196435 ZINC5496657 0 9 View
2332 4H-1,3,5-Dithiazine, 2,4,6-trimethyl- CC1N=C(SC(S1)C)C 94944-51-1 161.29 C6H11NS2 197828 ZINC5763949 0 2 View
2333 2,4,6-Triisobutyl-1,3,5-trioxane CC(C)CC1OC(OC(O1)CC(C)C)CC(C)C 68165-40-2 258.40 C15H30O3 198512 ZINC3643462 0 8 View
2334 1,5-Octadien-3-ol, (E)- CCC=CCC(C=C)O 83861-74-9 126.20 C8H14O 205986 ZINC3630807 0 8 View
2335 Berteroin CSCCCCCN=C=S 4430-42-6 175.31 C7H13NS2 206037 ZINC2558173 0 2 View
2336 4-Methyl-1-phenylpentan-2-one CC(C)CC(=O)CC1=CC=CC=C1 5349-62-2 176.25 C12H16O 219672 ZINC1591826 0 6 View
2337 5-Hydroxy-4-octanone CCCC(C(=O)CCC)O 496-77-5 144.21 C8H16O2 219794 ZINC1576855 0 4 View
2338 (1S,2S,4R)-2-Methoxy-1,7,7-trimethylbicyclo[2.2.1]heptane CC1(C2CCC1(C(C2)OC)C)C 5331-32-8 168.28 C11H20O 220050 ZINC1640792 0 5 View
2339 L-Menthyl acetate CC1CCC(C(C1)OC(=O)C)C(C)C 2623-23-6 198.30 C12H22O2 220674 ZINC1850068 0 15 View
2340 Propyl levulinate CCCOC(=O)CCC(=O)C 645-67-0 158.19 C8H14O3 221069 ZINC1680431 0 2 View
2341 3-Phenylpropyl hexanoate CCCCCC(=O)OCCCC1=CC=CC=C1 6281-40-9 234.33 C15H22O2 221417 ZINC1687357 0 3 View
2342 l-Menthyl propionate CCC(=O)OC1CC(CCC1C(C)C)C 4951-48-8 212.33 C13H24O2 221455 ZINC4409802 0 5 View
2343 1,3-Dioxolane-2-propanoic acid, 2,4-dimethyl-, ethyl ester CCOC(=O)CCC1(OCC(O1)C)C 5413-49-0 202.25 C10H18O4 221634 ZINC1693625 0 2 View
2344 1,3-Dioxolane, 4,5-dimethyl-2-phenyl- CC1C(OC(O1)C2=CC=CC=C2)C 4359-31-3 178.23 C11H14O2 221639 ZINC1693646 0 1 View
2345 Propyl phenylacetate CCCOC(=O)CC1=CC=CC=C1 4606-15-9 178.23 C11H14O2 221641 ZINC1693657 0 5 View
2346 2-Ethyl-2,5,5-trimethyl-4-(propan-2-yl)-1,3-dioxane CCC1(OCC(C(O1)C(C)C)(C)C)C 6290-33-1 200.32 C12H24O2 221668 ZINC1693718 0 2 View
2347 Hexyl phenylacetate CCCCCCOC(=O)CC1=CC=CC=C1 5421-17-0 220.31 C14H20O2 221691 ZINC1874360 0 10 View
2348 4-Allyl-2,6-dimethoxyphenol COC1=CC(=CC(=C1O)OC)CC=C 6627-88-9 194.23 C11H14O3 226486 ZINC404273 0 10 View
2349 Guaiol CC1CCC(CC2=C1CCC2C)C(C)(C)O 489-86-1 222.37 C15H26O 227829 ZINC1996067 0 4 View
2350 4,4-Dimethoxy-2-butanone CC(=O)CC(OC)OC 5436-21-5 132.16 C6H12O3 228548 ZINC1583673 0 7 View
Showing 2326 to 2350 of total 3985 entries