(1R,3S,4S,5S,7S,8R,9S,10R,11R)-7,8,9-Triacetyloxylongipinan-1-ol

(1R,3S,4S,5S,7S,8R,9S,10R,11R)-7,8,9-Triacetyloxylongipinan-1-ol

Common Name: (1R,3S,4S,5S,7S,8R,9S,10R,11R)-7,8,9-Triacetyloxylongipinan-1-ol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C21H32O7/c1-9-8-13(25)15-16-14(9)21(15,7)19(28-12(4)24)17(26-10(2)22)18(20(16,5)6)27-11(3)23/h9,13-19,25H,8H2,1-7H3/t9-,13+,14+,15-,16-,17+,18+,19+,21+/m0/s1

InChIKey: InChIKey=DFBRMSUZYLADCT-RMHOENSYSA-N

Formula: C21H32O7

Molecular Weight: 396.475392

Exact Mass: 396.214803

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Roman, L.U., Cerda-Garcia-Rojas, C.M., Guzman, R., Armenta, C., Hernandez, J.D., Joseph-Nathan, P. J Nat Prod (2002) 65, 1540-6

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Longipinanes; 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) 56.5
2 (CH) 45.1
3 (CH) 37.3
4 (CH2) 35.9
5 (CH) 74.1
6 (CH) 42.9
7 (C) 42.7
8 (CH) 77.1
9 (CH) 69.8
10 (CH) 71.6
11 (C) 34.8
12 (CH3) 26.9
13 (CH3) 19.6
14 (CH3) 21.4
15 (CH3) 21.5
8a (C) 171.4
8b (CH3) 20.9
9a (C) 170.5
9b (CH3) 20.8
10a (C) 170.1
10b (CH3) 20.7