| SpectraBase Compound ID | Bv5CPTen6m |
|---|---|
| InChI | InChI=1S/C22H34O3/c1-17(2)22-13-11-20(16-24-19(4)23)10-6-8-18(3)9-7-12-21(5,25-22)14-15-22/h9-11,13,17H,6-8,12,14-16H2,1-5H3/b13-11+,18-9+,20-10-/t21-,22+/m0/s1 |
| InChIKey | VJOLPTVYFWUITI-NBIXIGDJSA-N |
| Mol Weight | 346.5 g/mol |
| Molecular Formula | C22H34O3 |
| Exact Mass | 346.250795 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IYWSJl1Rw |
|---|---|
| Name | Lobophynin A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H34O3 |
| InChI | InChI=1S/C22H34O3/c1-17(2)22-13-11-20(16-24-19(4)23)10-6-8-18(3)9-7-12-21(5,25-22)14-15-22/h9-11,13,17H,6-8,12,14-16H2,1-5H3/b13-11+,18-9+,20-10-/t21-,22+/m0/s1 |
| InChIKey | VJOLPTVYFWUITI-NBIXIGDJSA-N |
| Molecular Weight | 346.511 g/mol |
| SMILES | [C@@]12(O[C@](CC\C=C/(C)CC\C=C\(\C=C\2)COC(=O)C)(C)CC1)C(C)C |
| SPLASH | splash10-053r-5953000000-c928a6f19e525f3e9ffe |
| Source of Spectrum | G4-60-801-1 |
| Synonyms | Acetic acid [(1S,4E,8Z,10E,12R)-1,5-dimethyl-12-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-4,8,10-trien-9-yl]methyl ester [(1S,4E,8Z,10E,12R)-1,5-dimethyl-12-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-4,8,10-trien-9-yl]methyl acetate [(1S,4E,8Z,10E,12R)-12-isopropyl-1,5-dimethyl-15-oxabicyclo[10.2.1]pentadeca-4,8,10-trien-9-yl]methyl acetate [(1S,4E,8Z,10E,12R)-1,5-dimethyl-12-propan-2-yl-15-oxabicyclo[10.2.1]pentadeca-4,8,10-trien-9-yl]methyl ethanoate |
| Wiley ID | 1606791 |