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
2526 1-Hydroxybutan-2-one CCC(=O)CO 5077-67-8 134.24 C6H14OS 521300 ZINC2005854 0 10 View
2527 Octyl heptanoate CCCCCCCCOC(=O)CCCCCC 5132-75-2 204.35 C15H24 521326 ZINC86022667 0 3 View
2528 3-Mercapto-1-hexanol CCCC(CCO)S 51755-83-0 168.30 C10H16S 521348 ZINC4271680 0 8 View
2529 Naphthalene, 1,2,4a,5,8,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)- CC1=CCC2C(C1)C(CC=C2C)C(C)C 29350-73-0 102.13 C5H10O2 521380 ZINC968462 0 4 View
2530 2-Butyl-5-ethylthiophene CCCCC1=CC=C(S1)CC 54411-06-2 128.19 C6H8OS 521504 ZINC2510289 0 4 View
2531 2-Hydroxy-3-pentanone CCC(=O)C(C)O 5704-20-1 132.27 C7H16S 521790 ZINC12153163 0 4 View
2532 5-Methyl-2-furanmethanethiol CC1=CC=C(O1)CS 59303-05-8 207.27 C12H17NO2 521873 ZINC32154769 0 3 View
2533 2-Heptanethiol CCCCCC(C)S 628-00-2 144.21 C8H16O2 522071 ZINC15272291 0 6 View
2534 Isobutyl 2-(methylamino)benzoate CC(C)COC(=O)C1=CC=CC=C1NC 65505-24-0 198.30 C12H22O2 522171 ZINC13346770 0 6 View
2535 Isopropyl 2-methylbutyrate CCC(C)C(=O)OC(C)C 66576-71-4 186.25 C10H18O3 522214 ZINC2575203 0 7 View
2536 Ethyl 9-decenoate CCOC(=O)CCCCCCCC=C 67233-91-4 256.42 C16H32O2 522255 ZINC32155366 0 7 View
2537 Isoamyl levulinate CC(C)CCOC(=O)CCC(=O)C 71172-75-3 164.33 C7H16S2 522404 ZINC32155554 0 2 View
2538 Heptyl nonan-1-oate CCCCCCCCC(=O)OCCCCCCC 71605-85-1 150.31 C6H14S2 522422 ZINC79084714 0 7 View
2539 Butyl propyl disulfide CCCCSSCCC 72437-64-0 154.25 C10H18O 522458 ZINC13380457 0 1 View
2540 Methyl pentyl disulfide CCCCCSSC 72437-68-4 224.34 C14H24O2 522459 ZINC14649287 0 2 View
2541 2,6,6-Trimethyl-2-vinyltetrahydropyran CC1(CCCC(O1)(C)C=C)C 7392-19-0 116.20 C4H4S2 522514 ZINC2517155 0 10 View
2542 Terpinyl isobutyrate CC1=CCC(CC1)C(C)(C)OC(=O)C(C)C 7774-65-4 228.37 C14H28O2 522673 ZINC14588966 0 10 View
2543 Thiophene-2-thiol C1=CSC(=C1)S 7774-74-5 158.19 C8H14O3 522674 ZINC2572266 0 4 View
2544 3-Methylbutyl nonanoate CCCCCCCCC(=O)OCCC(C)C 7779-70-6 227.26 C14H13NO2 522676 ZINC2564122 0 4 View
2545 Isobutyl acetoacetate CC(C)COC(=O)CC(=O)C 7779-75-1 111.14 C6H9NO 522677 ZINC2522787 0 4 View
2546 Benzyl anthranilate C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2N 82185-41-9 284.48 C18H36O2 522771 ZINC2169730 0 5 View
2547 2-Acetyl-1-pyrroline CC(=O)C1=NCCC1 85213-22-5 141.23 C7H11NS 522834 ZINC13305956 0 6 View
2548 Nonyl nonan-1-oate CCCCCCCCCOC(=O)CCCCCCCC 87310-12-1 152.23 C10H16O 522874 ZINC103830120 0 6 View
2549 2-Ethyl-4,5-dimethylthiazole CCC1=NC(=C(S1)C)C 873-64-3 130.14 C6H10O3 522877 ZINC2510290 0 4 View
2550 1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-5-ene CC1(C2CCC(O1)(C=C2)C)C 92760-25-3 196.24 C11H16O3 523035 ZINC15169330 0 2 View
Showing 2526 to 2550 of total 3985 entries