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Spectral Data   Additional Data   Download  
Molecule
60006088
Chemical name(s)3-(2-(1-Hydroxy-2alpha,5,5,8abeta-tetramethyldecalin-1beta-yl)ethyl)furan-2(5H)-one
Chemical formulaC20H32O3
Molecular weight320.467
Number of double bond equivalents (DBEs)5.0
Number of all rings, size of smallest set of smallest rings4, 3
Canonical name(s)
CAS-Number
Additional information
Links from Unichem: ChEMBL;ZINC;SureChEMBL;PubChem ('Thomson Pharma' subset);PubChem Compounds
Molecule keywords
DOI
13C Spectrum
60006994 Rating: 10
Type13C
Measurement conditions
Temperature [K]298
SolventChloroform-D1 (CDCl3)
Field Strength [MHz]100.0
Assignment MethodCOSY, HSQC, HMBC, NOESY
Literature Roshan R. Kulkarni; Vedavati G. Puranik; Ketaki Shurpali; Dhiman Sarkar; Swati P. Joshi: Journal of Natural Products, in: Antimycobacterial Labdane Diterpenes from Leucas stelligera, vol. 76/2013, pp. 1836 - 1841 (DOI: org/10.1021/np400002p).
Additional commentsd3-20413
Additional information
Spectrum categoriesocmainz inhouse-2




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