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
2601 2-Acetyl-4-isopropylpyridine CC(C)C1=CC(=NC=C1)C(=O)C 142896-09-1 163.22 C10H13NO 529345 ZINC32167294 0 6 View
2602 Pyridine, 2-ethyl-4-(1-methylethenyl) CCC1=NC=CC(=C1)C(=C)C 142896-08-0 147.22 C10H13N 529346 ZINC32167296 0 3 View
2603 4-Acetyl-2-isopropenylpyridine CC(=C)C1=NC=CC(=C1)C(=O)C 142896-12-6 161.20 C10H11NO 529352 ZINC32167307 0 4 View
2604 3-Methyl-1,2,4-trithiolane CC1SCSS1 51647-38-2 138.27 C3H6S3 529379 ZINC32167325 0 5 View
2605 1-Propanesulfonothioic acid, S-propyl ester CCCSS(=O)(=O)CCC 1113-13-9 182.30 C6H14O2S2 529388 ZINC22048402 0 2 View
2606 1,4,4-Trimethyltricyclo[5.3.1.02,6]undecan-11-ol CC1(CC2C3CCCC(C2C1)(C3O)C)C 56747-96-7 208.34 C14H24O 529438 ZINC32167469 0 4 View
2607 3-Methyl-2,4-nonanedione CCCCCC(=O)C(C)C(=O)C 113486-29-6 170.25 C10H18O2 529481 ZINC32167536 0 5 View
2608 2-Heptyl butyrate CCCCCC(C)OC(=O)CCC 39026-94-3 186.29 C11H22O2 529496 ZINC32167573 0 5 View
2609 2-Mercapto-3-pentanone CCC(=O)C(C)S 17042-24-9 118.20 C5H10OS 529635 ZINC32167692 0 2 View
2610 3-Nonenal, (3E)- CCCCCC=CCC=O 31823-43-5 140.22 C9H16O 529907 ZINC33820562 0 1 View
2611 6,7-Dihydro-2,5-dimethyl-5H-cyclopentapyrazine CC1CCC2=NC(=CN=C12)C 38917-61-2 148.20 C9H12N2 530404 ZINC2510282 0 6 View
2612 cis-beta-Farnesene CC(=CCCC(=CCCC(=C)C=C)C)C 28973-97-9 204.35 C15H24 531719 ZINC59586886 0 2 View
2613 Methyl isopentyl disulfide CC(C)CCSSC 72437-56-0 150.31 C6H14S2 534377 ZINC32182883 0 2 View
2614 8Ah-2,4a-methanonaphthalen-8a-ol, octahydro-1,1,5,5-tetramethyl- CC1(CCCC2(C13CCC(C3)C2(C)C)O)C 88644-30-8 222.37 C15H26O 534931 ZINC1081314 0 5 View
2615 2-Methyl-1-methylsulfanylbut-2-ene CC=C(C)CSC 89534-74-7 116.22 C6H12S 534969 ZINC33839397 0 3 View
2616 1,6-Octadiene, 8-methoxy- COCC=CCCCC=C 14543-49-8 140.22 C9H16O 535026 ZINC5511485 0 4 View
2617 Methyl propanesulfinate CCCS(=O)OC 41892-32-4 122.19 C4H10O2S 536502 ZINC38811676 0 3 View
2618 3-Mercaptohexyl hexanoate CCCCCC(=O)OCCC(CCC)S 136954-22-8 232.38 C12H24O2S 536987 ZINC14589062 0 4 View
2619 Heptan-3-yl acetate CCCCC(CC)OC(=O)C 5921-83-5 158.24 C9H18O2 537615 ZINC95618214 0 4 View
2620 Isoamyl pyruvate CC(C)CCOC(=O)C(=O)C 7779-72-8 158.19 C8H14O3 537682 ZINC2561201 0 6 View
2621 3-Mercaptohexyl butyrate CCCC(CCOC(=O)CCC)S 136954-21-7 204.33 C10H20O2S 537754 ZINC14589058 0 5 View
2622 Isoamyl 3-(2-furan)propionate CC(C)CCOC(=O)CCC1=CC=CO1 7779-67-1 210.27 C12H18O3 538506 ZINC2561200 0 9 View
2623 Vanillin isobutyrate CC(C)C(=O)OC1=C(C=C(C=C1)C=O)OC 20665-85-4 222.24 C12H14O4 539829 ZINC2534721 0 9 View
2624 Benzeneacetaldehyde, alpha-(2-methylpropylidene)- CC(C)C=C(C=O)C1=CC=CC=C1 26643-91-4 174.24 C12H14O 540124 ZINC5225050 0 8 View
2625 3,7-Dimethyloct-7-en-1-ol CC(CCCC(=C)C)CCO 141-25-3 156.27 C10H20O 543323 ZINC2508248 0 6 View
Showing 2601 to 2625 of total 3985 entries