(2R,5R,6R,7S)-Germacra-1(10)E,4(15)-dien-5-hydroperoxy-2,6-diol

(2R,5R,6R,7S)-Germacra-1(10)E,4(15)-dien-5-hydroperoxy-2,6-diol

Common Name: (2R,5R,6R,7S)-Germacra-1(10)E,4(15)-dien-5-hydroperoxy-2,6-diol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H26O4/c1-9(2)13-6-5-10(3)7-12(16)8-11(4)15(19-18)14(13)17/h7,9,12-18H,4-6,8H2,1-3H3/b10-7+/t12-,13-,14+,15-/m0/s1

InChIKey: InChIKey=WLCMBZTUSKXURS-FSNVIUNRSA-N

Formula: C15H26O4

Molecular Weight: 270.365118

Exact Mass: 270.183109

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Appendino, G., Aviello, G., Ballero, M., Borrelli, F., Fattorusso, E., Petrucci, F., Santelia, F.U., Taglialatela-Scafati, O. J Nat Prod (2005) 68, 853-7

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) 121.6
2 (CH) 69.5
3 (CH2) 43.4
4 (C) 138.8
5 (CH) 90.6
6 (CH) 70
7 (CH) 42
8 (CH2) 29.5
9 (CH2) 35.5
10 (C) 139.7
11 (CH) 31.3
12 (CH3) 21.2
13 (CH3) 21.3
14 (CH3) 21.4
15 (CH2) 117.5