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
3251 3-Benzyl-4-heptanone CCCC(=O)C(CC)CC1=CC=CC=C1 7492-37-7 204.31 C14H20O 5463905 ZINC2573799 0 7 View
3252 Butyl 2-decenoate CCCCCCCC=CC(=O)OCCCC 7492-45-7 226.36 C14H26O2 5463906 ZINC2575198 0 11 View
3253 4-(4-Methylphenyl)-2-butanone CC1=CC=C(C=C1)CCC(=O)C 7774-79-0 162.23 C11H14O 5463908 ZINC9280616 0 6 View
3254 (E)-Isoeugenyl formate CC=CC1=CC(=C(C=C1)OC=O)OC 7774-96-1 192.21 C11H12O3 5463909 ZINC14589768 0 5 View
3255 2,6-Dimethyloctanal CCC(C)CCCC(C)C=O 7779-07--9 156.27 C10H20O 5463910 ZINC000095619725/ 0 7 View
3256 Hydroxycitronellal diethyl acetal CCOC(CC(C)CCCC(C)(C)O)OCC 7779-94-4 246.39 C14H30O3 5463911 ZINC2384605 0 4 View
3257 Methyl-delta-ionone CCC(=O)C=CC1C(C=CCC1(C)C)C 7784-98-7 206.32 C14H22O 5463913 ZINC38611118 0 4 View
3258 Nonyl isovalerate CCCCCCCCCOC(=O)CC(C)C 7786-47-2 228.37 C14H28O2 5463914 ZINC2567766 0 4 View
3259 Ethyl 4-(methylthio)butyrate CCOC(=O)CCCSC 22014-48-8 162.25 C7H14O2S 5463935 ZINC38611803 0 2 View
3260 1-Ethoxy-3-methyl-2-butene CCOCC=C(C)C 22094-00-4 114.19 C7H14O 5463936 ZINC14590710 0 4 View
3261 Glyceryl 5-hydroxydecanoate CCCCCC(CCCC(=O)OCC(CO)O)O 26446-31-1 262.34 C13H26O5 5463954 ZINC2557905 0 5 View
3262 (R)-Lavandulol CC(=CCC(CO)C(=C)C)C 498-16-8 154.25 C10H18O 5464156 ZINC1846610 0 1 View
3263 Oxiranecarboxylic acid, 3-methyl-3-(2-(2,6,6-trimethyl-2-cyclohexen-1-yl)ethenyl)-, methyl ester CC1=CCCC(C1C=CC2(C(O2)C(=O)OC)C)(C)C 67905-40-2 264.36 C16H24O3 5472296 ZINC1661750 0 3 View
3264 trans-Anol CC=CC1=CC=C(C=C1)O 539-12-8 134.18 C9H10O 5474441 ZINC1696959 0 4 View
3265 (s)-2-Phenylpropanal CC(C=O)C1=CC=CC=C1 33530-47-1 134.18 C9H10O 5478986 ZINC1680784 0 3 View
3266 Dec-4-en-1-ol CCCCCC=CCCCO 72255-83-5 156.27 C10H20O 5702619 ZINC2560636 0 3 View
3267 4-Decenal CCCCCC=CCCC=O 65405-70-1 154.25 C10H18O 5702654 ZINC1850575 1 8 View
3268 4-Hydroxy-2,5-dimethylthiophen-3(2H)-one CC1C(=O)C(=C(S1)C)O 26494-10-0 144.19 C6H8O2S 5743410 ZINC38171353 0 2 View
3269 (Z)-3-Hexenyl cinnamate CC/C=C/CCOC(=O)/C=C/C1=CC=CC=C1 68133-75-5 230.30 C15H18O2 5744267 ZINC20231702 0 3 View
3270 (E)-6,10-Dimethylundeca-5,9-dien-2-yl acetate CC(CCC=C(C)CCC=C(C)C)OC(=O)C 3239-35-8 238.37 C15H26O2 5752319 ZINC2137477 0 9 View
3271 4,11,11-Trimethyl-8-methylenebicyclo[7.2.0]undec-3-en-5-yl acetate CC1=CCC2C(CC2(C)C)C(=C)CCC1OC(=O)C 32214-91-8 262.39 C17H26O2 5832948 ZINC3978587 0 5 View
3272 (,6E)-3,7-Dimethyl-2,6-octadienyl cinnamate CC(=CCCC(=CCOC(=O)C=CC1=CC=CC=C1)C)C 71605-84-0 284.39 C19H24O2 5862476 ZINC3171691 0 3 View
3273 Oxacycloheptadec-7-en-2-one C1CCCCC=CCCCCC(=O)OCCCC1 7779-50-2 252.39 C16H28O2 5869600 ZINC196561579 0 10 View
3274 m-Dioxane, 4-methyl-2-styryl- CC1CCOC(O1)C=CC2=CC=CC=C2 5420-98-4 204.26 C13H16O2 5905098 ZINC1874299 0 5 View
3275 4-Methyl-2-pentenal CC(C)C=CC=O 5362-56-1 98.14 C6H10O 5916154 ZINC1602581 0 12 View
Showing 3251 to 3275 of total 3985 entries