Jatrogrossidione

Jatrogrossidione

Common Name: Jatrogrossidione

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H28O4/c1-10-8-13-12(18(13,3)4)6-7-19(5)17(24-19)14-15(21)11(2)9-20(14,23)16(10)22/h9-10,12-14,17,23H,6-8H2,1-5H3/t10-,12+,13-,14+,17-,19-,20-/m1/s1

InChIKey: InChIKey=XZYCFPQDVLVQIF-QXCLFMBXSA-N

Formula: C20H28O4

Molecular Weight: 332.434679

Exact Mass: 332.198759

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Morgenstern, T., Bittner, M., Silva, M., Aqueveque, P., Jakupovic, J. Phytochemistry (1996) 41, 1149-53

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Lathyranes; 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) 152.7
2 (C) 142.7
3 (C) 203.4
4 (CH) 62.4
5 (CH) 57.7
6 (C) 58.6
7 (CH2) 41
8 (CH2) 18.4
9 (CH) 29.1
10 (C) 16.5
11 (CH) 18.7
12 (CH2) 24.3
13 (CH) 37.6
14 (C) 214
15 (C) 86.4
16 (CH3) 10.2
17 (CH3) 18.3
18 (CH3) 28.2
19 (CH3) 15.4
20 (CH3) 14.6