Trihydroxyisodaucane

Trihydroxyisodaucane

Common Name: Trihydroxyisodaucane

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H28O3/c1-9(2)10-5-7-14(3)11(16)6-8-15(4,18)13(17)12(10)14/h9-13,16-18H,5-8H2,1-4H3/t10-,11+,12+,13+,14-,15-/m0/s1

InChIKey: InChIKey=XUVQJFBJHKRROA-ZYIYBEKCSA-N

Formula: C15H28O3

Molecular Weight: 256.381594

Exact Mass: 256.203845

NMR Solvent: C+M

MHz:

Calibration:

NMR references: 13C - Tchuendem, M.H., Mbah, J.A., Tsopmo, A., Ayafor, J.F., Sterner, O., Okunjic, C.C., Iwu, M.M., Schuster, B.M. Phytochemistry (1999) 52, 1095-9

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Isodaucanes; 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 (C) 48.4
2 (CH2) 39.2
3 (CH2) 24.3
4 (CH) 50.3
5 (CH) 51.6
6 (CH) 76.7
7 (C) 73.8
8 (CH2) 33.4
9 (CH2) 27.9
10 (CH) 74.9
11 (CH) 31.9
12 (CH3) 22.4
13 (CH3) 17.6
14 (CH3) 25.7
15 (CH3) 25.6