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
1601 4-Ethyl-1,2-dimethoxybenzene CCC1=CC(=C(C=C1)OC)OC 5888-51-7 166.22 C10H14O2 79990 ZINC2567866 0 4 View
1602 1-Methylhexyl acetate CCCCCC(C)OC(=O)C 5921-82-4 158.24 C9H18O2 80018 ZINC5513363 0 4 View
1603 S-Methyl thiobenzoat CSC(=O)C1=CC=CC=C1 5925-68-8 152.21 C8H8OS 80024 ZINC401997 0 8 View
1604 Diisopropyl trisulfide CC(C)SSSC(C)C 5943-34-0 182.37 C6H14S3 80046 ZINC5442514 0 5 View
1605 (R)-(-)-2-Octanol CCCCCCC(C)O 5978-70-1 130.23 C8H18O 80080 ZINC1653215 0 4 View
1606 (2-Nitroethyl)benzene C1=CC=C(C=C1)CC[N+](=O)[O-] 6125-24-2 151.16 C8H9NO2 80208 ZINC1608651 0 2 View
1607 Cyclododecyl acetate CC(=O)OC1CCCCCCCCCCC1 6221-92-7 226.36 C14H26O2 80353 ZINC5437780 0 4 View
1608 Dodecyl propionate CCCCCCCCCCCCOC(=O)CC 6221-93-8 242.40 C15H30O2 80354 ZINC59283873 0 3 View
1609 Cyclohexyl hexanoate CCCCCC(=O)OC1CCCCC1 6243-10--3 198.30 C12H22O2 80388 ZINC1684883 0 2 View
1610 4-Methoxy-alpha-toluenethiol COC1=CC=C(C=C1)CS 6258-60-2 154.23 C8H10OS 80407 ZINC388092 0 5 View
1611 2-Thiophenemethanethiol C1=CSC(=C1)CS 6258-63-5 130.23 C5H6S2 80408 ZINC153137 0 4 View
1612 Furfuryl isobutyrate CC(C)C(=O)OCC1=CC=CO1 6270-55-9 168.19 C9H12O3 80454 ZINC1668233 0 2 View
1613 2-(Ethoxymethyl)furan CCOCC1=CC=CO1 6270-56-0 126.15 C7H10O2 80455 ZINC1668234 0 7 View
1614 (2,2-Diethoxyethyl)benzene CCOC(CC1=CC=CC=C1)OCC 6314-97-2 194.27 C12H18O2 80584 ZINC1570892 0 6 View
1615 Allyl valerate CCCCC(=O)OCC=C 6321-45-5 142.20 C8H14O2 80606 ZINC1665012 0 1 View
1616 Carvacrol methyl ether CC1=C(C=C(C=C1)C(C)C)OC 6379-73-3 164.24 C11H16O 80790 ZINC1599255 0 4 View
1617 1,3-Dioxolane-2-acetic acid, 2-methyl-, ethyl ester CCOC(=O)CC1(OCCO1)C 6413-10--1 174.19 C8H14O4 80865 ZINC160855 3 9 View
1618 Benzyl nonanoate CCCCCCCCC(=O)OCC1=CC=CC=C1 6471-66-5 248.36 C16H24O2 80960 ZINC2564120 0 4 View
1619 Propyl nonanoate CCCCCCCCC(=O)OCCC 6513-03--7 200.32 C12H24O2 81006 ZINC2515964 0 3 View
1620 Hexyl nonanoate CCCCCCCCC(=O)OCCCCCC 6561-39-3 242.40 C15H30O2 81045 ZINC95618220 0 5 View
1621 2,4-Dimethylanisole CC1=CC(=C(C=C1)OC)C 6738-23-4 136.19 C9H12O 81221 ZINC1723266 0 2 View
1622 Thiocyanic acid, hexyl ester CCCCCCSC#N 6803-40-3 143.25 C7H13NS 81257 ZINC1648383 0 3 View
1623 2-(p-Tolyloxy)ethyl acetate CC1=CC=C(C=C1)OCCOC(=O)C 6807-11-0 194.23 C11H14O3 81258 ZINC2522781 0 5 View
1624 Rhodinol CC(CCCC(=C)C)CCO 141-25-3 156.27 C10H20O 81263 ZINC2508248 0 22 View
1625 Heptyl hexanoate CCCCCCCOC(=O)CCCCC 6976-72-3 214.34 C13H26O2 81464 ZINC1615264 0 2 View
Showing 1601 to 1625 of total 3985 entries