Kavain
2225
Reference
Kavain Structure
Systematic / IUPAC Name: 4-Methoxy-2-[(E)-2-phenylethenyl]-2,3-dihydropyran-6-one
ID: Reference2225
Other Names:
Kawain;
Neuronica;
Cavain;
Gonosan;
DL-Kavain
; more
Formula: C14H14O3
Class: Endogenous Metabolites Therapeutics/Prescription Drugs Natural Products/Medicines
Spectral Data
Kavain mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Plus Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 45 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 2/10/2015 8:48:35 AM |
Identificators
| InChI | InChI=1S/C14H14O3/c1-16-13-9-12(17-14(15)10-13)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+ |
| InChI Key | XEAQIWGXBXCYFX-BQYQJAHWSA-N |
| Canonical SMILES | COC1=CC(=O)OC(C1)C=CC2=CC=CC=C2 |
| CAS | 3155484 |
| Splash | |
| Other Names |
Kawain; Neuronica; Cavain; Gonosan; DL-Kavain; 2H-Pyran-2-one, 5,6-dihydro-4-methoxy-6-styryl-; 4-Methoxy-6-(β-phenylvinyl)-5,6-dihydro-α-pyrone; 4-Methoxy-6-(2-phenylethenyl)-5,6-dihydro-2H-pyran-2-one; 2H-Pyran-2-one, 5,6-dihydro-4-methoxy-6-(2-phenylethenyl)-; 5-Hydroxy-3-methoxy-7-phenyl-2,6-heptadienoic acid Υ-lactone; 2,6-Heptadienoic acid, 5-hydroxy-3-methoxy-7-phenyl-, δ-lactone |