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
1376 Pentyl valerate CCCCCOC(=O)CCCC 2173-56-0 172.26 C10H20O2 62433 ZINC1707855 0 9 View
1377 Allyl methyl disulfide CSSCC=C 2179-58-0 120.24 C4H8S2 62434 ZINC1531088 0 5 View
1378 S-Methyl butanethioate CCCC(=O)SC 2432-51-1 118.20 C5H10OS 62444 ZINC409240 2 13 View
1379 2-Methylbutyl isovalerate CCC(C)COC(=O)CC(C)C 2445-77-4 172.26 C10H20O2 62445 ZINC1849951 0 15 View
1380 4-Vinylphenol C=CC1=CC=C(C=C1)O 2628-17-3 120.15 C8H8O 62453 ZINC895826 0 11 View
1381 4-Ethyl-2-methoxyphenol CCC1=CC(=C(C=C1)O)OC 2785-89-9 152.19 C9H12O2 62465 ZINC1631205 2 10 View
1382 Ethyl 2-benzylbutanoate CCC(CC1=CC=CC=C1)C(=O)OCC 2983-36-0 206.28 C13H18O2 62469 ZINC1849924 0 4 View
1383 3-Hydroxy-2-pentanone CCC(C(=O)C)O 3142-66-3 102.13 C5H10O2 62484 ZINC1849913 0 2 View
1384 2-(3-Phenylpropyl)tetrahydrofuran C1CC(OC1)CCCC2=CC=CC=C2 3208-40-0 190.28 C13H18O 62490 ZINC1849896 0 3 View
1385 4,5-Dimethylthiazole CC1=C(SC=N1)C 3581-91-7 113.18 C5H7NS 62510 ZINC407027 0 11 View
1386 3,4-Hexanedione CCC(=O)C(=O)CC 4437-51-8 114.14 C6H10O2 62539 ZINC1602516 5 7 View
1387 Isopropyl phenylacetate CC(C)OC(=O)CC1=CC=CC=C1 4861-85-2 178.23 C11H14O2 62553 ZINC1849853 0 8 View
1388 (-)-beta-Bourbonene CC(C)C1CCC2(C1C3C2CCC3=C)C 5208-59-3 204.35 C15H24 62566 ZINC1565154 0 8 View
1389 Amyl laurate CCCCCCCCCCCC(=O)OCCCCC 5350-03--8 270.45 C17H34O2 62571 ZINC100005054 0 4 View
1390 Ethyl 3-hydroxybutyrate CCOC(=O)CC(C)O 5405-41-4 132.16 C6H12O3 62572 ZINC388764 0 8 View
1391 Hexyl pivalate CCCCCCOC(=O)C(C)(C)C 5434-57-1 186.29 C11H22O2 62575 ZINC1711253 0 9 View
1392 3-Phenylpropyl isovalerate CC(C)CC(=O)OCCCC1=CC=CC=C1 5452-07--3 220.31 C14H20O2 62578 ZINC2558678 0 4 View
1393 Piperonyl isobutyrate CC(C)C(=O)OCC1=CC2=C(C=C1)OCO2 5461-08--5 222.24 C12H14O4 62580 ZINC56507 0 8 View
1394 7-Butyloxepan-2-one CCCCC1CCCCC(=O)O1 5579-78-2 170.25 C10H18O2 62583 ZINC1849842 0 10 View
1395 Heptyl butyrate CCCCCCCOC(=O)CCC 5870-93-9 186.29 C11H22O2 62592 ZINC1849834 0 9 View
1396 Benzenepropanal, 4-(1-methylethyl)- CC(C)C1=CC=C(C=C1)CCC=O 7775-00-0 176.25 C12H16O 62654 ZINC1849808 0 5 View
1397 4-Methyl-1-phenyl-2-pentanol CC(C)CC(CC1=CC=CC=C1)O 7779-78-4 178.27 C12H18O 62661 ZINC1849801 0 8 View
1398 2-Isobutylthiazole CC(C)CC1=NC=CS1 18640-74-9 141.23 C7H11NS 62725 ZINC164545 0 12 View
1399 3-Ethyl-2-hydroxy-2-cyclopenten-1-one CCC1=C(C(=O)CC1)O 21835-01-8 126.15 C7H10O2 62752 ZINC25695693 0 12 View
1400 3-Hydroxy-4,5-dimethylfuran-2(5H)-one CC1C(=C(C(=O)O1)O)C 28664-35-9 128.13 C6H8O3 62835 ZINC22000195 1 19 View
Showing 1376 to 1400 of total 3985 entries