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
1326 Ethyl 2-methyl-4-pentenoate CCOC(=O)C(C)CC=C 53399-81-8 142.20 C8H14O2 62024 ZINC1850413 0 10 View
1327 2-Ethyl-4,5-dimethyloxazole CCC1=NC(=C(O1)C)C 53833-30-0 125.17 C7H11NO 62069 ZINC1850395 0 5 View
1328 3-Mercapto-2-butanol CC(C(C)S)O 37887-04-0 106.19 C4H10OS 62087 ZINC4501354 0 6 View
1329 4-Methyloctanoic acid CCCCC(C)CCC(=O)O 54947-74-9 158.24 C9H18O2 62089 ZINC1850362 0 13 View
1330 3-((2-Mercapto-1-methylpropyl)thio)-2-butanol CC(C(C)SC(C)C(C)S)O 54957-02-7 194.36 C8H18OS2 62090 ZINC5298949 0 6 View
1331 p-Cresyl isovalerate CC1=CC=C(C=C1)OC(=O)CC(C)C 55066-56-3 192.25 C12H16O2 62092 ZINC1664926 0 5 View
1332 cis,cis-Photocitral A CC1CCC(C1C=O)C(=C)C 55253-28-6 152.23 C10H16O 62095 ZINC5735741 0 3 View
1333 Piperonyl acetone CC(=O)CCC1=CC2=C(C=C1)OCO2 55418-52-5 192.21 C11H12O3 62098 ZINC52601 1 11 View
1334 2,5-Dimethyl-1,4-dithiane-2,5-diol CC1(CSC(CS1)(C)O)O 55704-78-4 180.29 C6H12O2S2 62105 ZINC1720584 0 9 View
1335 S-(2,5-Dimethyl-3-furanyl) 2-furancarbothioate CC1=CC(=C(O1)C)SC(=O)C2=CC=CO2 55764-31-3 222.26 C11H10O3S 62106 ZINC1850354  0 1 View
1336 1,2,5,6-Tetrahydrocuminic acid CC(C)C1=CCC(CC1)C(=O)O 71298-42-5 168.23 C10H16O2 62117 ZINC1850349 0 4 View
1337 beta-Caryophyllene alcohol acetate CC(=O)OC12CCCC(C1)(CCC3C2CC3(C)C)C 57082-24-3 264.40 C17H28O2 62127 ZINC5438241  0 7 View
1338 2-Methyltetrahydrofuran-3-thiol CC1C(CCO1)S 57124-87-5 118.20 C5H10OS 62128 ZINC4262494 0 8 View
1339 Methyl furfuryl disulfide CSSCC1=CC=CO1 57500-00-2 160.26 C6H8OS2 62131 ZINC1850325 0 14 View
1340 Furfuryl thiopropionate CCC(=O)SCC1=CC=CO1 59020-85-8 170.23 C8H10O2S 62143 ZINC157016 0 6 View
1341 2-Furanmethanethiol formate C1=COC(=C1)CSC=O 59020-90-5 142.18 C6H6O2S 62144 ZINC1850318 0 11 View
1342 2-Mercaptomethylpyrazine C1=CN=C(C=N1)CS 59021-02-2 126.18 C5H6N2S 62145 ZINC8100931 0 3 View
1343 3-(Hydroxymethyl)octan-2-one CCCCCC(CO)C(=O)C 59191-78-5 158.24 C9H18O2 62148 ZINC1850311 0 7 View
1344 Menthyl lactate CC1CCC(C(C1)OC(=O)C(C)O)C(C)C 59259-38-0 228.33 C13H24O3 62151 ZINC2539653 0 2 View
1345 Ethyl 2-methyl-3,4-pentadienoate CCOC(=O)C(C)C=C=C 60523-21-9 140.18 C8H12O2 62166 ZINC1850303 0 7 View
1346 4-((2-Methyl-3-furyl)thio)-5-nonanone CCCCC(=O)C(CCC)SC1=C(OC=C1)C 61295-50-9 254.39 C14H22O2S 62182 ZINC1850293 0 2 View
1347 2,6-Dimethyl-3-((2-methyl-3-furyl)thio)-4-heptanone CC1=C(C=CO1)SC(C(C)C)C(=O)CC(C)C 61295-51-0 254.39 C14H22O2S 62183 ZINC1850291 0 4 View
1348 Naphthalen-2-yl 2-aminobenzoate C1=CC=C2C=C(C=CC2=C1)OC(=O)C3=CC=CC=C3N 63449-68-3 263.29 C17H13NO2 62217 ZINC1850213 0 8 View
1349 2-Pentyl-1-buten-3-one CCCCCC(=C)C(=O)C 63759-55-7 140.22 C9H16O 62218 ZINC1850211 0 5 View
1350 Oct-6-enal CC=CCCCCC=O 63196-63-4 126.20 C8H14O 62220 ZINC44709727 0 2 View
Showing 1326 to 1350 of total 3985 entries