Spektraris NMR
3-Oxosclareolide
Common Name: 3-Oxosclareolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H24O3/c1-14(2)10-5-8-16(4)11(9-13(18)19-16)15(10,3)7-6-12(14)17/h10-11H,5-9H2,1-4H3/t10-,11+,15-,16+/m0/s1
InChIKey: InChIKey=JQBCYOREBVVBBP-KTQGLZRJSA-N
Formula: C16H24O3
Molecular Weight: 264.360567
Exact Mass: 264.172545
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hanson, J.R., Truneh, A. Phytochemistry (1996) 42, 1021-3
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (CH2) | 37.7 |
| 2 (CH2) | 33.4 |
| 3 (C) | 215.5 |
| 4 (C) | 47.3 |
| 5 (CH) | 54.3 |
| 6 (CH2) | 21.4 |
| 7 (CH2) | 37.7 |
| 8 (C) | 85.6 |
| 9 (CH) | 58.1 |
| 10 (C) | 35.5 |
| 11 (CH2) | 28.6 |
| 12 (C) | 175.9 |
| 17 (CH3) | 21.1 |
| 18 (CH3) | 26.6 |
| 19 (CH3) | 20.7 |
| 20 (CH3) | 14.5 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.