Common Name: InChI=1/C20H32/c1-15-7-6-8-16(2)10-14-19-17(3)11-13-18(12-9-15)20(19,4)5/h8-9,18-19H,3,6-7,10-14H2,1-2,4-5H3/b15-9+,16-8+/t18-,19+/m0/s
Synonyms: InChI=1/C20H32/c1-15-7-6-8-16(2)10-14-19-17(3)11-13-18(12-9-15)20(19,4)5/h8-9,18-19H,3,6-7,10-14H2,1-2,4-5H3/b15-9+,16-8+/t18-,19+/m0/s
CAS Registry Number:
InChI: InChI=1S/C20H32/c1-15-7-6-8-16(2)10-14-19-17(3)11-13-18(12-9-15)20(19,4)5/h8-9,18-19H,3,6-7,10-14H2,1-2,4-5H3/b15-9+,16-8+/t18-,19-/m1/s1
InChIKey: InChIKey=FDBOKUQSBGGGJO-TXLKRMSRSA-N
Formula: C20H32
Molecular Weight: 272.468822
Exact Mass: 272.250401
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hernandez-Hernandez, J.D., Roman-Marin, L.U., Cerda-Garcia-Rojas, C.M., Joseph-Nathan, P. J Nat Prod (2005) 68, 1598-602
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Verticillanes; 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) | 44.8 |
2 (CH2) | 33.5 |
3 (CH) | 127.3 |
4 (C) | 132.9 |
5 (CH2) | 41.3 |
6 (CH2) | 26.4 |
7 (CH) | 128.3 |
8 (C) | 133.9 |
9 (CH2) | 37.7 |
10 (CH2) | 19.4 |
11 (CH) | 42.6 |
12 (C) | 149.6 |
13 (CH2) | 36.1 |
14 (CH2) | 30.3 |
15 (C) | 37.7 |
16 (CH3) | 24.4 |
17 (CH3) | 27.3 |
18 (CH2) | 105.2 |
19 (CH3) | 15.6 |
20 (CH3) | 15 |