Common Name: Vitetrifolin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H32O4/c1-15-18(26-16(2)23)13-19-20(3,4)9-6-10-21(19,5)22(15,24)11-7-17-8-12-25-14-17/h8,12-15,18,24H,6-7,9-11H2,1-5H3/t15-,18+,21+,22-/m1/s1
InChIKey: InChIKey=SGXFKBQPKLDSQY-RWBNYIAVSA-N
Formula: C22H32O4
Molecular Weight: 360.487914
Exact Mass: 360.23006
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ono, M., Sawamura, H., Ito, Y., Mizuki, K., Nohara, T. Phytochemistry (2000) 55, 873-7
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) | 30.6 |
2 (CH2) | 17.9 |
3 (CH2) | 39.7 |
4 (C) | 35.8 |
5 (C) | 153.9 |
6 (CH) | 118.6 |
7 (CH) | 75.1 |
8 (CH) | 38.3 |
9 (C) | 78.3 |
10 (C) | 45.2 |
11 (CH2) | 33.8 |
12 (CH2) | 21 |
13 (C) | 125.6 |
14 (CH) | 110.9 |
15 (CH) | 142.8 |
16 (CH) | 138.5 |
17 (CH3) | 13 |
18 (CH3) | 32.5 |
19 (CH3) | 31 |
20 (CH3) | 25.2 |
7a (C) | 171.4 |
7b (CH3) | 21.4 |