Common Name: Ambreinolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H28O2/c1-15(2)9-5-10-16(3)12(15)8-11-17(4)13(16)6-7-14(18)19-17/h12-13H,5-11H2,1-4H3/t12-,13+,16-,17+/m0/s1
InChIKey: InChIKey=OXLWUQRYCMJFSG-UWWPHRKUSA-N
Formula: C17H28O2
Molecular Weight: 264.403661
Exact Mass: 264.20893
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Dolmazon, R., Albrand, M., Bessiere, J.M., Mahmout, Y., Wernerowska, D., Kolodziejczyk, K. Phytochemistry (1995) 38, 917-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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 (CH2) | 39.2 |
2 (CH2) | 18.4 |
3 (CH2) | 41.8 |
4 (C) | 33.3 |
5 (CH) | 56 |
6 (CH2) | 19.6 |
7 (CH2) | 29 |
8 (C) | 83.8 |
9 (CH) | 53.6 |
10 (C) | 37.3 |
11 (CH2) | 15.8 |
12 (CH2) | 41.2 |
13 (C) | 171.7 |
17 (CH3) | 22.9 |
18 (CH3) | 33.2 |
19 (CH3) | 21.5 |
20 (CH3) | 15.1 |