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
1351 3-Mercapto-2-pentanone CCC(C(=O)C)S 67633-97-0 118.20 C5H10OS 62237 ZINC4802621 0 17 View
1352 2-Tert-Pentylcyclohexyl acetate CCC(C)(C)C1CCCCC1OC(=O)C 67874-72-0 212.33 C13H24O2 62240 ZINC410085 0 6 View
1353 Methyl cedryl ether CC1CCC2C13CCC(C(C3)C2(C)C)(C)OC 67874-81-1 236.39 C16H28O 62241 ZINC199877258 0 4 View
1354 Linalyl butyrate CCCC(=O)OC(C)(CCC=C(C)C)C=C 78-36-4 224.34 C14H24O2 62321 ZINC1677812 0 11 View
1355 2-Mercaptopropionic acid CC(C(=O)O)S 79-42-5 106.14 C3H6O2S 62326 ZINC3860781 0 5 View
1356 Terpinyl propionate CCC(=O)OC(C)(C)C1CCC(=CC1)C 80-27-3 210.31 C13H22O2 62328 ZINC1850071 0 7 View
1357 Musk xylene CC1=C(C(=C(C(=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-])C)[N+](=O)[O-] 81-15-2 297.26 C12H15N3O6 62329 ZINC40454343 0 5 View
1358 Phenethyl salicylate C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2O 87-22-9 242.27 C15H14O3 62332 ZINC397608 0 7 View
1359 Diethyl tartrate CCOC(=O)C(C(C(=O)OCC)O)O 57968-71-5 206.19 C8H14O6 62333 ZINC1648298 0 3 View
1360 2-Tert-Butylcyclohexyl acetate CC(=O)OC1CCCCC1C(C)(C)C 88-41-5 198.30 C12H22O2 62334 ZINC399108 0 7 View
1361 2-Phenylpropionaldehyde dimethyl acetal CC(C1=CC=CC=C1)C(OC)OC 90-87-9 180.24 C11H16O2 62336 ZINC389503 0 12 View
1362 1-Phenylethyl acetate CC(C1=CC=CC=C1)OC(=O)C 93-92-5 164.20 C10H12O2 62341 ZINC409284 1 17 View
1363 Vanillyl alcohol COC1=C(C=CC(=C1)CO)O 498-00-0 154.16 C8H10O3 62348 ZINC164388  0 10 View
1364 7-Isopropyl-4-methyloxepan-2-one CC1CCC(OC(=O)C1)C(C)C 499-54-7 170.25 C10H18O2 62349 ZINC1850044 0 4 View
1365 3-(Methylthio)propyl isothiocyanate CSCCCN=C=S 505-79-3 147.26 C5H9NS2 62351 ZINC1850039 0 10 View
1366 Eugenyl benzoate COC1=C(C=CC(=C1)CC=C)OC(=O)C2=CC=CC=C2 531-26-0 268.31 C17H16O3 62362 ZINC519080 0 3 View
1367 Sabinene hydrate CC(C)C12CCC(C1C2)(C)O 546-79-2 154.25 C10H18O 62367 ZINC30724426 0 4 View
1368 2,6,6-Trimethylcyclohex-2-ene-1,4-dione CC1=CC(=O)CC(C1=O)(C)C 1125-21-9 152.19 C9H12O2 62374 ZINC3881445 0 12 View
1369 Benzaldehyde dimethyl acetal COC(C1=CC=CC=C1)OC 1125-88-8 152.19 C9H12O2 62375 ZINC389865 0 9 View
1370 Dihydrojasmone CCCCCC1=C(CCC1=O)C 1128-08-1 166.26 C11H18O 62378 ZINC4521084 10 12 View
1371 2,2,4-Trimethyl-1,3-dioxolane CC1COC(O1)(C)C 1193-11-9 116.16 C6H12O2 62384 ZINC1562141 0 13 View
1372 1-Methyl-4-(prop-1-en-2-yl)benzene CC1=CC=C(C=C1)C(=C)C 1195-32-0 132.20 C10H12 62385 ZINC1584796 0 11 View
1373 Isobornyl formate CC1(C2CCC1(C(C2)OC=O)C)C 1200-67-5 182.26 C11H18O2 62387 ZINC2567764 0 6 View
1374 Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, methyl ester CCC=CCC1C(CCC1=O)CC(=O)OC 39924-52-2 224.30 C13H20O3 62388 ZINC4654657 0 5 View
1375 2-Pentanethiol CCCC(C)S 2084-19-7 104.21 C5H12S 62424 ZINC5298826 0 2 View
Showing 1351 to 1375 of total 3985 entries