(1R,4aalpha)-6alpha-Isopropyl-8abeta-methyl-4-methylenedecalin-1beta,2alpha,5alpha-triol

(1R,4aalpha)-6alpha-Isopropyl-8abeta-methyl-4-methylenedecalin-1beta,2alpha,5alpha-triol

Common Name: (1R,4aalpha)-6alpha-Isopropyl-8abeta-methyl-4-methylenedecalin-1beta,2alpha,5alpha-triol

Synonyms: (1R,4aalpha)-6alpha-Isopropyl-8abeta-methyl-4-methylenedecalin-1beta,2alpha,5alpha-triol

CAS Registry Number:

InChI: InChI=1S/C15H26O3/c1-8(2)10-5-6-15(4)12(13(10)17)9(3)7-11(16)14(15)18/h8,10-14,16-18H,3,5-7H2,1-2,4H3/t10-,11+,12-,13+,14-,15-/m0/s1

InChIKey: InChIKey=QZZPVQAAGDDIRD-DEPYFDJDSA-N

Formula: C15H26O3

Molecular Weight: 254.365713

Exact Mass: 254.188195

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Fattorusso, E., Santelia, F.U., Appendino, G., Ballero, M., Taglialatela-Scafati, O. J Nat Prod (2004) 67, 37-41

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)

Carbon NMR Peaks

Position PPM
1 (CH) 84
2 (CH) 72.2
3 (CH2) 44
4 (C) 144
5 (CH) 50.7
6 (CH) 70
7 (CH) 44.7
8 (CH2) 22.9
9 (CH2) 32.3
10 (C) 40.2
11 (CH) 30.1
12 (CH3) 25.3
13 (CH3) 25.5
14 (CH3) 13
15 (CH2) 109.7