(1(10)E)-5β-Hydroxygermacra-1(10),4(15),11-trien-8, 12-olide

(1(10)E)-5β-Hydroxygermacra-1(10),4(15),11-trien-8, 12-olide

Common Name: (1(10)E)-5β-Hydroxygermacra-1(10),4(15),11-trien-8, 12-olide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H20O3/c1-9-5-4-6-10(2)13(16)8-12-11(3)15(17)18-14(12)7-9/h5,12-14,16H,2-4,6-8H2,1H3/b9-5+/t12-,13+,14+/m1/s1

InChIKey: InChIKey=KOZHGHBBKHOGEC-HQJYEZFTSA-N

Formula: C15H20O3

Molecular Weight: 248.318068

Exact Mass: 248.141245

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Huo, Y., Shi, H.M., Wang, M.Y., Li, X.B. Magn Reson Chem (2008) 46, 1208-11

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Germacranes; 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) 129.5
2 (CH2) 25.4
3 (CH2) 24.9
4 (C) 147.9
5 (CH) 76.8
6 (CH2) 36.7
7 (CH) 40.5
8 (CH) 80.2
9 (CH2) 45.5
10 (C) 129.3
11 (C) 141.6
12 (C) 170
13 (CH2) 120.3
14 (CH3) 16.8
15 (CH2) 117