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
3551 2,6-Dimethylbenzenethiolate CC1=C(C(=CC=C1)C)[S-] CAS-2 116.20 C7H16O 6997373 ZINC19735105 0 6 View
3552 (3S)-Heptan-3-ol CCCCC(CC)O 26549-25-7 143.20 C8H15O2 6998928 ZINC2003567 0 2 View
3553 (2S)-2-Methylheptanoate CCCCC[C@H](C)C(=O)[O-] CAS-3 198.30 C12H22O2 6999929 ZINC2039800 0 5 View
3554 6-Octen-1-ol, 3,7-dimethyl-, acetate, (3S)- CC(CCC=C(C)C)CCOC(=O)C 67601-05-2 146.18 C7H14O3 6999975 ZINC2040946 0 6 View
3555 Propanoic acid, 2-hydroxy-, butyl ester, (2S)- CCCCOC(=O)C(C)O 34451-19-9 170.25 C10H18O2 6999977 ZINC2040992 0 6 View
3556 (5S)-5-Hexyloxolan-2-one CCCCCCC1CCC(=O)O1 107797-27-3 104.21 C5H12S 7057904 ZINC3860323 0 3 View
3557 (2S)-2-Methyloxolan-3-one CC1C(=O)CCO1 3188-00-9 154.25 C10H18O 7060523 ZINC3880802 0 8 View
3558 trans-Rose oxide CC1CCOC(C1)C=C(C)C 5258--11-7 130.18 C7H14O2 7093102 ZINC4082316 0 1 View
3559 Ethyl (2R)-2-methylbutanoate CCC(C)C(=O)OCC 10307-61-6 118.20 C5H10OS 7156991 ZINC4261992 0 4 View
3560 (2S,3R)-2-Methyltetrahydrofuran-3-thiol CC1C(CCO1)S 26548-78-7 238.41 C16H30O 7157263 ZINC4262495 0 1 View
3561 Cyclopentadecanone, 3-methyl-, (3R)- CC1CCCCCCCCCCCCC(=O)C1 10403-00-6 134.24 C6H14OS 7160826 ZINC4269341 0 3 View
3562 (s)-3-Mercaptohexanol CCCC(CCO)S 90180-90-8 150.22 C10H14O 7162054 ZINC4271680 0 7 View
3563 (-)-Menthofuran CC1CCC2=C(C1)OC=C2C 80183-38-6 104.17 C4H8OS 7168192 ZINC4284443 0 4 View
3564 (-)-Nootkatone CC1CC(=O)C=C2C1(CC(CC2)C(=C)C)C 38427-78-0 126.20 C8H14O 7567181 ZINC5225089 0 1 View
3565 (S)-5-Methyl-2-hepten-4-one CCC(C)C(=O)C=CC 122440-59-9 126.20 C8H14O 7567850 ZINC100003882 0 4 View
3566 2-Octanone, oxime CCCCCCC(=NO)C 7207-49-0 143.23 C8H17NO 9562584 ZINC14616810 0 6 View
3567 1-Hexanol, 3-mercapto-3-methyl-, (3R)- CCCC(C)(CCO)S 828300-39-6 148.27 C7H16OS 9793841 ZINC14589101 0 3 View
3568 S-Allyl-L-cysteine C=CCSCC(C(=O)O)N 21593-77-1 161.22 C6H11NO2S 9793905 ZINC1621720 0 2 View
3569 6-Octen-3-one, 2,4,4,7-tetramethyl- CC(C)C(=O)C(C)(C)CC=C(C)C 74338-72-0 182.30 C12H22O 9815427 ZINC113072229 0 7 View
3570 Ethyl butyryl lactate CCCC(=O)OC(C)C(=O)OCC 71662-27-6 188.22 C9H16O4 9815474 ZINC38633035 0 4 View
3571 2-Cyclododecylpropan-1-ol CC(CO)C1CCCCCCCCCCC1 118562-73-5 226.40 C15H30O 9815980 ZINC113510709 0 3 View
3572 Ethyl 3-mercaptobutyrate CCOC(=O)CC(C)S 156472-94-5 148.22 C6H12O2S 9833996 ZINC33975163 0 4 View
3573 1,2-Propanediol, 2-methyl-3-[[(1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl]oxy]- CC1CCC(C(C1)OCC(C)(CO)O)C(C)C 195863-84-4 244.37 C14H28O3 9834711 ZINC33975938 0 2 View
3574 2-Buten-1-one, 1-(2,2-dimethyl-6-methylenecyclohexyl)- CC=CC(=O)C1C(=C)CCCC1(C)C 35087-49-1 192.30 C13H20O 9837013 ZINC100154426 0 8 View
3575 Valencene CC1CCC=C2C1(CC(CC2)C(=C)C)C 4630--07-3 204.35 C15H24 9855795 ZINC1734352 0 8 View
Showing 3551 to 3575 of total 3985 entries