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
3851 3-(Methylthio)propyl mercaptoacetate CSCCCOC(=O)CS 852997-30-9 180.29 C6H12O2S2 46779104 ZINC44029964 0 10 View
3852 7-Methylhexahydro-2H-benzo[b][1,4]dioxepin-3(4H)-one CC1CCC2C(C1)OCC(=O)CO2 1217714-24-3 184.23 C10H16O3 46835217 ZINC40435178 0 6 View
3853 2,3-Epoxyheptanal CCCCC1C(O1)C=O 58936-30-4 128.17 C7H12O2 19876973 ZINC33951640 0 3 View
3854 Dihydro-2,4,6-tris(2-methylpropyl)-4h-1,3,5-dithiazine CC(C)CC1NC(SC(S1)CC(C)C)CC(C)C 74595-94-1 289.54 C15H31NS2 46941523 ZINC66331979 0 6 View
3855 S-(2,5-Dimethylfuran-3-yl) furan-3-carbothioate CC1=CC(=C(O1)C)SC(=O)C2=COC=C2 65505-16-0 222.26 C11H10O3S 53230316 ZINC1852801 0 3 View
3856 2-(4-Methyl-5-thiazolyl)ethyl octanoate OGJATLSJIMPQBD-UHFFFAOYSA-N 163266-17-9 269.40 C14H23NO2S 53338773 ZINC95618235 0 2 View
3857 Acetaldehyde hexyl isoamyl acetal CCCCCCOC(C)OCCC(C)C 233665-90-2 216.36 C13H28O2 53422473 ZINC90440654 0 3 View
3858 2,4-Dimethyl-2-pentenoic acid CC(C)C=C(C)C(=O)O 3876-52-6 128.17 C7H12O2 53422899 ZINC82719763 0 4 View
3859 2,4-Difurfurylfuran C1=COC(=C1)CC2=CC(=CO2)CC3=CC=CO3 64280-32-6 228.24 C14H12O3 53423642 ZINC95618199 0 2 View
3860 1-(5,6-Dimethylpyrazin-2-yl)ethanone CC1=NC=C(N=C1C)C(=O)C 54300-10-6 150.18 C8H10N2O 53423848 ZINC2546204 0 3 View
3861 Methyl 2-butyl-2-ethylhexanoate CCCCC(CC)(CCCC)C(=O)OC 106887-88-1 214.34 C13H26O2 53424394 ZINC199943283 0 1 View
3862 Ethyl propyl trisulfide CCCSSSCC 31499-70-4 168.34 C5H12S3 53425122 ZINC104397239 0 5 View
3863 3-Mercapto-3-methylbutyl isovalerate CC(C)CC(=O)OCCC(C)(C)S 612071-27-9 204.33 C10H20O2S 53425775 ZINC90766946 0 4 View
3864 4-Acetyl-2,5-dimethylfuran-3(2H)-one CC1C(=O)C(=C(O1)C)C(=O)C 36871-78-0 154.16 C8H10O3 53426546 ZINC85221875 0 2 View
3865 CID 53426765 CC(=C)OC(=O)CCC(=O)C 1070-35-5 156.18 C8H12O3 53426765 ZINC200016558 0 3 View
3866 7-Tetradecen-2-one, (7E)- CCCCCCC=CCCCCC(=O)C 146955-45-5 210.36 C14H26O 53427622 ZINC100104940 0 4 View
3867 Propanoic acid, 2,2-dimethyl-, 3-methyl-3-buten-1-yl ester CC(=C)CCOC(=O)C(C)(C)C 104468-21-5 170.25 C10H18O2 53428828 ZINC96336389 0 6 View
3868 5-Pentyl-1,4-dioxan-2-one CCCCCC1COC(=O)CO1 65504-96-3 172.22 C9H16O3 53435896 ZINC95619611 0 2 View
3869 Nonyl heptanoate CCCCCCCCCOC(=O)CCCCCC 98841-69-1 256.42 C16H32O2 53437836 ZINC113380533 0 4 View
3870 3-(4,7,7-Trimethylbicyclo(4.1.0)hept-3-ylidene)propiononitrile CC1CC2C(C2(C)C)CC1=CCC#N 68804-02-4 189.30 C13H19N 53470669 ZINC34599563 0 4 View
3871 S-Prenyl thioisopentanoate CC(C)CC(=O)SCC=C(C)C 75631-91-3 186.31 C10H18OS 53471638 ZINC14590679 0 6 View
3872 D-Isoleucine methyl ester hydrochloride CCC(C)C(C(=O)OC)N.Cl 8002-72-0 181.66 C7H16ClNO2 53472027 0 2 View
3873 2-Buten-1-one, 1-(2,2,6-trimethylcyclohexyl)- CC=CC(=O)C1C(CCCC1(C)C)C 39900-18-0 194.31 C13H22O 53754001 ZINC33985322 0 2 View
3874 1,3,5,7-Undecatetraene, (Z,Z,E)- CCCC=CC=CC=CC=C 116963-97-4 148.24 C11H16 53930276 ZINC90416826 0 5 View
3875 Hex-3-enyl hexadecanoate CCCCCCCCCCCCCCCC(=O)OCCC=CCC 233666-03-0 338.57 C22H42O2 53936829 ZINC100306062 0 3 View
Showing 3851 to 3875 of total 3985 entries