Common Name: 3β,8α-dihydroxy-13-pyrrolidine-4(15),10(14)-(1αH,5αH,6βH,11βH)-guaiadien-12,6-olide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H27NO4/c1-10-7-15(22)17-13(9-20-5-3-4-6-20)19(23)24-18(17)16-11(2)14(21)8-12(10)16/h12-18,21-22H,1-9H2/t12-,13+,14-,15-,16-,17+,18+/m0/s1
InChIKey: InChIKey=BHSNJDDWJASFBW-QEEAWNDNSA-N
Formula: C19H27N1O4
Molecular Weight: 333.422745
Exact Mass: 333.194008
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Zhan, Z.J., Hou, X.R. Nat Prod Res (2008) 22, 222-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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)
Position | PPM |
---|---|
1 (CH) | 44 |
2 (CH2) | 38.9 |
3 (CH) | 73 |
4 (C) | 154.3 |
5 (CH) | 49.7 |
6 (CH) | 79.3 |
7 (CH) | 57.6 |
8 (CH) | 73.2 |
9 (CH2) | 42.7 |
10 (C) | 145 |
11 (CH) | 46.5 |
12 (C) | 175.8 |
13 (CH2) | 56.5 |
14 (CH2) | 110.3 |
15 (CH2) | 114.9 |
13a (CH2) | 53.7 |
13b (CH2) | 23.6 |
13c (CH2) | 23.6 |
13d (CH2) | 53.7 |