1α,8β,10β-trihydroxy-6β-(2-methylacryloyl)oxyeremophil-7(11)-en-8α,12-olide

1α,8β,10β-trihydroxy-6β-(2-methylacryloyl)oxyeremophil-7(11)-en-8α,12-olide

Common Name: 1α,8β,10β-trihydroxy-6β-(2-methylacryloyl)oxyeremophil-7(11)-en-8α,12-olide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C19H26O7/c1-9(2)15(21)25-14-13-11(4)16(22)26-19(13,24)8-18(23)12(20)7-6-10(3)17(14,18)5/h10,12,14,20,23-24H,1,6-8H2,2-5H3/t10-,12-,14+,17-,18+,19-/m0/s1

InChIKey: InChIKey=UUMFIBPKUOLWFQ-ZKNBXXKVSA-N

Formula: C19H26O7

Molecular Weight: 366.406276

Exact Mass: 366.167853

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Fei, D.Q., Zhang, Z.X. Chin Chem Lett (2009) 20, 949-51

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 (CH) 71.4
2 (CH2) 28.1
3 (CH2) 28.3
4 (CH) 33.3
5 (C) 47.6
6 (CH) 72.2
7 (C) 151.2
8 (C) 103.1
9 (CH2) 37.1
10 (C) 77.2
11 (C) 129.2
12 (C) 170.8
13 (CH3) 8.8
14 (CH3) 10.9
15 (CH3) 16.3
6a (C) 166.7
6b (C) 135.5
6c (CH2) 127.1
6ba (CH3) 18.2