3β-angeloyloxy-8β-hydroxy-6α,15β-epoxyeremophil-7(11)-en-12,8α-olide

3β-angeloyloxy-8β-hydroxy-6α,15β-epoxyeremophil-7(11)-en-12,8α-olide

Common Name: 3β-angeloyloxy-8β-hydroxy-6α,15β-epoxyeremophil-7(11)-en-12,8α-olide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H26O6/c1-5-10(2)17(21)25-14-7-6-12-8-20(23)15(11(3)18(22)26-20)16-19(12,4)13(14)9-24-16/h5,12-14,16,23H,6-9H2,1-4H3/b10-5-/t12-,13+,14+,16+,19+,20+/m1/s1

InChIKey: InChIKey=WLEGVCDLXXAIOU-JEMBISANSA-N

Formula: C20H26O6

Molecular Weight: 362.417607

Exact Mass: 362.172939

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Yamada, T., Minoura, K., Tanaka, R., Numata, A. J Antibiot (2006) 59, 345-50

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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 (CH2) 21.1
2 (CH2) 25.6
3 (CH) 66.4
4 (CH) 40.6
5 (C) 44.3
6 (CH) 83.3
7 (C) 157.9
8 (C) 104.1
9 (CH2) 36.4
10 (CH) 35
11 (C) 125.6
12 (C) 172.4
13 (CH3) 8.3
14 (CH3) 21.8
15 (CH2) 66.6
3a (C) 167.3
3b (C) 127.3
3c (CH) 139.4
3d (CH3) 15.7
3ba (CH3) 20.8