Linearol
[(1R,2S,5S,6R,9S,10S,13S)-2,6-dihydroxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate
Also Known As: Linearol|Oct-4t-en-2-on|3,7-Dihydroxykaur-16-en-19-yl acetate|(dihydroxy-dimethyl-methylene-[?]yl)methyl acetate|[(1R,2S,5S,6R,9S,10S,13S)-2,6-Dihydroxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate|(3alpha,4beta,7beta,8alpha,9beta,10alpha)-3,7-Dihydroxykaur-16-en-19-yl, acetate-|((3R,4S,6S,6aR,9S,11aS,11bS)-3,6-dihydroxy-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalen-4-yl)methyl acetate|(5xi)-3alpha,7beta-Dihydroxy-8alpha,9beta,10alpha-kaur-16-en-19-yl acetate|((1R,2S,5S,6R,9S,10S,13S)-2,6-dihydroxy-5,9-dimethyl-14-methylidene-5-tetracyclo(11.2.1.01,10.04,9)hexadecanyl)methyl acetate|(3.alpha.,4.beta.,7.beta.,8.alpha.,9.beta.,10.alpha.)-3,7-Dihydroxykaur-16-en-19-yl, acetate-|1-((1R,3S,6S,9R,10R)-3,9-dihydroxy-6,10-dimethyl-2-methylidene-12-oxatricyclo(7.2.1.01,6)dodecan-10-yl)-4-methylpentan-3-one
| Molecular Formula | C22H34O4 |
|---|---|
| Molecular Weight | 362.2457 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.2457 |
| Monoisotopic Mass | 362.2457 |
| Heavy Atoms | 26 |
| Complexity | 630.0 |
Chemical Identifiers
| CAS Number | 37720-82-4 |
|---|---|
| SMILES | CC(=O)OC[C@]1([C@@H](CC[C@@]2(C1C[C@@H]([C@]34[C@H]2CC[C@@H](C3)C(=C)C4)O)C)O)C |
| InChIKey | FOSUPIBQARPELG-FOYJWTFCSA-N |
Product Overview
Linearol (CAS 37720-82-4), with molecular formula C22H34O4 and molecular weight 362.2457 g/mol. IUPAC: [(1R,2S,5S,6R,9S,10S,13S)-2,6-dihydroxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate.
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