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
3501 cis-3-Hexen-1yl 2-methylpent-2-en-1-oate CCC=CCCOC(=O)C(=CCC)C 76649-17-7 196.29 C12H20O2 6441873 ZINC83310088 0 7 View
3502 1-Butyl-5-carboxypentyl 5-decenoate CCCCC=CCCCC(=O)OC(CCCC)CCCCC(=O)O 85392-05-8 340.50 C20H36O4 6441973 ZINC5819761 0 8 View
3503 (Z)-1,1-Diethoxy-4-decene CCCCCC=CCCC(OCC)OCC 73545-19-4 228.37 C14H28O2 6442059 ZINC33955262 0 3 View
3504 (2e,4e,7z)-2,4,7-Decatrienal CCC=CCC=CC=CC=O 66642-86-2 150.22 C10H14O 6442642 ZINC13433779 0 2 View
3505 Methyl 2-[cinnamylideneamino]benzoate COC(=O)C1=CC=CC=C1N=CC=CC2=CC=CC=C2 94386-48-8 265.31 C17H15NO2 6445555 ZINC38652088 0 4 View
3506 alpha-Santalyl acetate CC(=CCCC1(C2CC3C1(C3C2)C)C)COC(=O)C 41414-75-9 262.39 C17H26O2 6445771 ZINC3598530 0 3 View
3507 2-Phenyl-2-pentenal CCC=C(C=O)C1=CC=CC=C1 3491-63-2 160.21 C11H12O 6450204 ZINC2510135 0 10 View
3508 Geranyl heptanoate CCCCCCC(=O)OCC=C(C)CCC=C(C)C 73019-15-5 266.42 C17H30O2 6450452 ZINC33952497 0 4 View
3509 (3E)-Trideca-3,12-dienenitrile C=CCCCCCCCC=CCC#N 134769-33-8 191.31 C13H21N 6450538 ZINC113290954 0 7 View
3510 Vitispirane CC1CCC2(O1)C(=C)C=CCC2(C)C 65416-59-3 192.30 C13H20O 6450832 ZINC14883474 0 8 View
3511 1,2,3-Propanetriol, cyclic ether with (2-methylphenyl)methanediol CC1=CC=CC=C1C(O)O.C(C(CO)O)O 1333-09-1 230.26 C11H18O5 6451245 0 3 View
3512 1-Oxaspiro(4.5)decan-2-one, 8-(1-methylethyl)-, trans- CC(C)C1CCC2(CC1)CCC(=O)O2 4625-90-5 196.29 C12H20O2 6452049 ZINC33986100 0 4 View
3513 Glucovanillin COC1=C(C=CC(=C1)C=O)OC2C(C(C(C(O2)CO)O)O)O 494-08-6 314.29 C14H18O8 6452133 ZINC4081510 0 1 View
3514 2-Ethoxy-4-(methoxymethyl)phenol CCOC1=C(C=CC(=C1)COC)O 5595-79-9 182.22 C10H14O3 6453284 ZINC13481851 0 10 View
3515 1-(3,3-Dimethylcyclohexyl)pent-4-en-1-one CC1(CCCC(C1)C(=O)CCC=C)C 56973-87-6 194.31 C13H22O 6453423 ZINC34064267 0 7 View
3516 2-Hexyl-5-keto-1,4-dioxane CCCCCCC1COC(=O)CO1 65504-97-4 186.25 C10H18O3 6455146 ZINC34065042 0 5 View
3517 4-(4-Methyl-3-cyclohexen-1-ylidene)pentanal CC1=CCC(=C(C)CCC=O)CC1 32540-03-7 178.27 C12H18O 6504440 ZINC5766858 0 2 View
3518 trans-Isogeraniol CC(=CCC=C(C)CCO)C 16750-94-0 154.25 C10H18O 6536347 ZINC15120483 0 1 View
3519 4,8-Dimethyl-3,7-nonadien-2-one CC(=CCCC(=CC(=O)C)C)C 817-88-9 166.26 C11H18O 6536892 ZINC33841603 0 6 View
3520 DSSTox_CID_5186 CCC(O)OC(CC)O 25265-71-8 134.17 C6H14O3 6537503 ZINC13827790 0 1 View
3521 (13Z)-Oxacyclohexadecen-2-one C1CCCCCC(=O)OCCC=CCCCC1 111879-81-3 238.37 C15H26O2 6537739 ZINC5189301 0 1 View
3522 2,4-Hexadienyl butyrate CCCC(=O)OCC=CC=CC 95994-93-7 168.23 C10H16O2 6537958 ZINC2384555 0 5 View
3523 2-Butyl-2-butenal CCCCC(=CC)C=O 25409-08-9 126.20 C8H14O 6540477 ZINC34114939 0 2 View
3524 (+)-Borneol CC1(C2CCC1(C(C2)O)C)C 464-43-7 154.25 C10H18O 6552009 ZINC100046356 0 5 View
3525 (S)-delta-Decanolide CCCCCC1CCCC(=O)O1 59285-67-5 170.25 C10H18O2 6566010 ZINC4283873 0 5 View
Showing 3501 to 3525 of total 3985 entries