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
2726 Isobutyl cinnamate CC(C)COC(=O)C=CC1=CC=CC=C1 122-67-8 194.23 C11H14O3 778574 ZINC270595  0 6 View
2727 Guaiacol isobutyrate CC(C)C(=O)OC1=CC=CC=C1OC 723759-62-4 164.20 C10H12O2 836904 ZINC364009 0 2 View
2728 Isoeugenol CC=CC1=CC(=C(C=C1)O)OC 97-54-1 206.24 C12H14O3 853433 ZINC391122 7 8 View
2729 2-[(1h-Benzimidazol-2-ylmethyl)sulfanyl]-n-(naphthalen-2-yl)acetamide C1=CC=C2C=C(C=CC2=C1)NC(=O)CSCC3=NC4=CC=CC=C4N 5925-75-7 250.38 C16H26O2 877369 ZINC32154765 0 5 View
2730 Sclareolide CC1(CCCC2(C1CCC3(C2CC(=O)O3)C)C)C 564-20-5 208.30 C13H20O2 929262 ZINC519827 0 8 View
2731 Nopyl acetate, (-)- CC(=O)OCCC1=CCC2CC1C2(C)C 35836-72-7 371.43 C21H25NO5 929336 ZINC519934 0 1 View
2732 N-(2-(3,4-Dimethoxyphenyl)ethyl)-3,4-dimethoxycinnamic acid amide COC1=C(C=C(C=C1)CCNC(=O)C=CC2=CC(=C(C=C2)OC)OC)OC 69444-90-2 152.23 C10H16O 1042025 ZINC714631 0 2 View
2733 (+)-Fenchone CC1(C2CCC(C2)(C1=O)C)C 4695-62-9 150.22 C10H14O 1201521 ZINC967570 6 12 View
2734 Bicyclo(3.1.1)hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-, (1S)- CC1(C2CC=C(C1C2)C=O)C 23727-16-4 150.22 C10H14O 1201528 ZINC968030 0 1 View
2735 (-)-Myrtenal CC1(C2CC=C(C1C2)C=O)C 18486-69-6 152.23 C10H16O 1201529 ZINC968030 0 15 View
2736 (-)-trans-Pinocarveol CC1(C2CC1C(=C)C(C2)O)C 547-61-5 222.37 C15H26O 1201530 ZINC968034 0 4 View
2737 (+)-Epi-alpha-bisabolol CC1=CCC(CC1)C(C)(CCC=C(C)C)O 515-69-5 218.33 C15H22O 1201551 ZINC1849759 0 4 View
2738 Nootkatone CC1CC(=O)C=C2C1(CC(CC2)C(=C)C)C 4674-50-4 171.24 C12H13N 1268142 ZINC1081321  0 6 View
2739 (Z)-3-Methyl-5-phenylpent-2-enenitrile CC(=CC#N)CCC1=CC=CC=C1 53243-59-7 305.41 C18H27NO3 1381163 ZINC1233747 0 3 View
2740 Capsaicin CC(C)C=CCCCCC(=O)NCC1=CC(=C(C=C1)O)OC 404-86-4 164.24 C11H16O 1548943 ZINC1530575 0 3 View
2741 Jasmone CCC=CCC1=C(CCC1=O)C 488-10-8 164.24 C11H16O 1549018 ZINC4467398 0 8 View
2742 (E)-Jasmone CCC=CCC1=C(CCC1=O)C 6261-18-3 196.29 C12H20O2 1549019 ZINC1531140 0 2 View
2743 Neryl acetate CC(=CCCC(=CCOC(=O)C)C)C 141-12-8 196.29 C12H20O2 1549025 ZINC4528568 1 23 View
2744 Geranyl acetate CC(=CCCC(=CCOC(=O)C)C)C 105-87-3 148.20 C10H12O 1549026 ZINC1531610 8 9 View
2745 cis-Anethole CC=CC1=CC=C(C=C1)OC 25679-28-1 164.20 C10H12O2 1549040 ZINC12358735 0 1 View
2746 cis-Isoeugenol CC=CC1=CC(=C(C=C1)O)OC 5912-86-7 178.23 C11H14O2 1549041 ZINC12405001 0 2 View
2747 Isoeugenyl methyl ether CC=CC1=CC(=C(C=C1)OC)OC 6380-24-1 222.37 C15H26O 1549045 ZINC14680002 1 5 View
2748 (2Z,6E)-Farnesol CC(=CCCC(=CCCC(=CCO)C)C)C 3790-71-4 122.12 C7H6O2 1549108 ZINC13507234  0 1 View
2749 3-(2-Furyl)acrolein C1=COC(=C1)C=CC=O 623-30-3 204.31 C14H20O 1549521 ZINC6096965 0 9 View
2750 Butylphenyl methylpropional, (-)- CC(CC1=CC=C(C=C1)C(C)(C)C)C=O 75166-31-3 194.31 C13H22O 1549660 ZINC1589924 0 2 View
Showing 2726 to 2750 of total 3985 entries