Common Name: (4aS,8aS)-3,5,8a-trimethyl-4a,7,8,8a-tetrahydronaphtho[2,3-b]furan-9(4H)-one
Synonyms: (4aS,8aS)-3,5,8a-trimethyl-4a,7,8,8a-tetrahydronaphtho[2,3-b]furan-9(4H)-one
CAS Registry Number:
InChI: InChI=1S/C15H18O2/c1-9-5-4-6-15(3)12(9)7-11-10(2)8-17-13(11)14(15)16/h5,8,12H,4,6-7H2,1-3H3/t12-,15-/m0/s1
InChIKey: InChIKey=PJUXIGJXLKHONL-WFASDCNBSA-N
Formula: C15H18O2
Molecular Weight: 230.302782
Exact Mass: 230.13068
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Yim, N.H., Hwang, E.I., Yun, B.S., Park, K.D., Moon, J.S., Lee, S.H., Sung, N.D., Kim, S.U. Biol Pharm Bull (2008) 31, 1041-4
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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)
Position | PPM |
---|---|
1 (CH2) | 29.1 |
2 (CH2) | 23.1 |
3 (CH) | 123.1 |
4 (C) | 134 |
5 (CH) | 46.7 |
6 (CH2) | 22.9 |
7 (C) | 140.4 |
8 (C) | 147.5 |
9 (C) | 194.3 |
10 (C) | 45.8 |
11 (C) | 122.6 |
12 (CH) | 146.7 |
13 (CH3) | 7.6 |
14 (CH3) | 15.5 |
15 (CH3) | 21.1 |