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
201 Isopentyl benzoate CC(C)CCOC(=O)C1=CC=CC=C1 94-46-2 192.25 C12H16O2 7193 ZINC394936 0 5 View
202 Phenethyl benzoate C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2 94-47-3 226.27 C15H14O2 7194 ZINC410077 0 3 View
203 Dihydrosafrole CCCC1=CC2=C(C=C1)OCO2 94-58-6 164.20 C10H12O2 7197 ZINC1641645 0 2 View
204 Benzothiazole C1=CC=C2C(=C1)N=CS2 95-16-9 135.19 C7H5NS 7222 ZINC19726 2 9 View
205 2-Methylindole CC1=CC2=CC=CC=C2N1 95-20-5 131.17 C9H9N 7224 ZINC1088076 0 3 View
206 2-Methylbenzoxazole CC1=NC2=CC=CC=C2O1 95-21-6 133.15 C8H7NO 7225 ZINC388067  0 11 View
207 O-Xylene CC1=CC=CC=C1C 95-47-6 106.17 C8H10 7237 ZINC968282 0 1 View
208 1,2,4-Trimethylbenzene CC1=CC(=C(C=C1)C)C 95-63-6 120.19 C9H12 7247 ZINC1692473 0 2 View
209 3,4-Dimethylphenol CC1=C(C=C(C=C1)O)C 95-65-8 122.16 C8H10O 7249 ZINC1576886 0 1 View
210 2,5-Dimethylphenol CC1=CC(=C(C=C1)C)O 95-87-4 122.16 C8H10O 7267 ZINC1641024 0 7 View
211 1,2,4,5-Tetramethylbenzene CC1=CC(=C(C=C1C)C)C 95-93-2 134.22 C10H14 7269 ZINC1295393 0 2 View
212 Styrene oxide C1C(O1)C2=CC=CC=C2 96-09-3 120.15 C8H8O 7276 ZINC901249 0 0 View
213 2-Methylbutylamine CCC(C)CN 96-15-1 87.16 C5H13N 7283 ZINC2041176 0 1 View
214 2-Methylbutyraldehyde CCC(C)C=O 96-17-3 86.13 C5H10O 7284 ZINC901301  0 10 View
215 3-Pentanone CCC(=O)CC 96-22-0 86.13 C5H10O 7288 ZINC1648158 0 2 View
216 gamma-Butyrolactone C1CC(=O)OC1 96-48-0 86.09 C4H6O2 7302 ZINC4658567 0 6 View
217 1-Methylpyrrole CN1C=CC=C1 96-54-8 81.12 C5H7N 7304 ZINC1692446 0 3 View
218 2,4-Di-tert-butylphenol CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C 96-76-4 206.32 C14H22O 7311 ZINC1081075 0 1 View
219 Ethyl chrysanthemate CCOC(=O)C1C(C1(C)C)C=C(C)C 97-41-6 196.29 C12H20O2 7334 ZINC119389 0 8 View
220 Carvyl acetate CC1=CCC(CC1OC(=O)C)C(=C)C 97-42-7 194.27 C12H18O2 7335 ZINC404784 0 7 View
221 Carvyl propionate CCC(=O)OC1CC(CC=C1C)C(=C)C 97-45-0 208.30 C13H20O2 7336 ZINC56528 0 4 View
222 2-Methylpentanoic acid CCCC(C)C(=O)O 97-61-0 116.16 C6H12O2 7341 ZINC2384645 0 4 View
223 Ethyl isobutyrate CCOC(=O)C(C)C 97-62-1 116.16 C6H12O2 7342 ZINC391109 3 10 View
224 Ethyl methacrylate CCOC(=O)C(=C)C 97-63-2 114.14 C6H10O2 7343 ZINC1608906 0 4 View
225 Ethyl lactate CCOC(=O)C(C)O 97-64-3 118.13 C5H10O3 7344 ZINC391792 0 10 View
Showing 201 to 225 of total 3985 entries