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
1551 2-Methylthiazole CC1=NC=CS1 3581-87-1 99.15 C4H5NS 77129 ZINC2510297 0 2 View
1552 Diethyl trisulfide CCSSSCC 3600-24-6 154.32 C4H10S3 77151 ZINC1632448 0 3 View
1553 1,1-Diethoxyhexane CCCCCC(OCC)OCC 3658-93-3 174.28 C10H22O2 77224 ZINC2504529 0 7 View
1554 Cycloheptadecanone C1CCCCCCCCC(=O)CCCCCCC1 3661-77-6 252.44 C17H32O 77226 ZINC5189332 0 1 View
1555 Methyl octyl sulfide CCCCCCCCSC 3698-95-1 160.32 C9H20S 77289 ZINC2168407 0 6 View
1556 3-Methylthiopropylamine CSCCCN 4104-45-4 105.20 C4H11NS 77743 ZINC1529637 0 4 View
1557 Guaiacol butyrate CCCC(=O)OC1=CC=CC=C1OC 4112-92-9 194.23 C11H14O3 77756 ZINC363974 0 2 View
1558 Mercaptoacetaldehyde C(C=O)S 4124-63-4 76.12 C2H4OS 77775 ZINC15830129 0 1 View
1559 2,5-Dimethylthiazole CC1=CN=C(S1)C 4175-66-0 113.18 C5H7NS 77837 ZINC5783274 0 8 View
1560 Diisopropyl disulfide CC(C)SSC(C)C 4253-89-8 150.31 C6H14S2 77932 ZINC1674078 0 7 View
1561 1-Methyl-1,4-cyclohexadiene CC1=CCC=CC1 4313-57-9 94.15 C7H10 78006 ZINC1699512 0 0 View
1562 (R)-2-Ethylhexanoic acid CCCCC(CC)C(=O)O 56006-48-5 144.21 C8H16O2 78052 ZINC1849774  0 3 View
1563 2-Heptyl-1,3-dioxolane CCCCCCCC1OCCO1 4359-57-3 172.26 C10H20O2 78067 ZINC2559071 0 5 View
1564 Hexyl isothiocyanate CCCCCCN=C=S 4404-45-9 143.25 C7H13NS 78120 ZINC2146665 0 6 View
1565 2-Phenylethanethiol C1=CC=C(C=C1)CCS 4410-99-5 138.23 C8H10S 78126 ZINC4271722 0 3 View
1566 Erucin CSCCCCN=C=S 4430-36-8 161.29 C6H11NS2 78160 ZINC2383009 0 3 View
1567 Ethyl (methylthio)acetate CCOC(=O)CSC 4455-13-4 134.20 C5H10O2S 78199 ZINC407006 0 11 View
1568 2,3-Dimethoxytoluene CC1=C(C(=CC=C1)OC)OC 4463-33-6 152.19 C9H12O2 78215 ZINC388105 0 0 View
1569 3-Propylpyridine CCCC1=CN=CC=C1 4673-31-8 121.18 C8H11N 78405 ZINC967178 0 8 View
1570 Methyl 2,4-dihydroxy-3,6-dimethylbenzoate CC1=CC(=C(C(=C1C(=O)OC)O)C)O 4707-47-5 196.20 C10H12O4 78435 ZINC239015  0 5 View
1571 2-Benzyl-1,3-dioxan-5-ol C1C(COC(O1)CC2=CC=CC=C2)O 4740-79-8 194.23 C11H14O3 78476 ZINC5851109 0 9 View
1572 1-Methoxyhexane CCCCCCOC 4747-07--3 116.20 C7H16O 78484 ZINC2560611 0 5 View
1573 5-Methyl-5-phenylhexan-3-one CCC(=O)CC(C)(C)C1=CC=CC=C1 4927-36-0 190.28 C13H18O 78639 ZINC2294896 0 5 View
1574 4-Cyclohexyl-4-methylpentan-2-one CC(=O)CC(C)(C)C1CCCCC1 4927-39-3 182.30 C12H22O 78640 ZINC50934988 0 4 View
1575 Oxacyclohexadec-13-en-2-one, (13Z)- C1CCCCCC(=O)OCCC=CCCCC1 4941-78-0 238.37 C15H26O2 78653 ZINC5189301 0 1 View
Showing 1551 to 1575 of total 3985 entries