3b-Acetoxy-14-n-butyryloxy-10-deoxyfloridanolide

3b-Acetoxy-14-n-butyryloxy-10-deoxyfloridanolide

Common Name: 3b-Acetoxy-14-n-butyryloxy-10-deoxyfloridanolide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C21H32O8/c1-6-7-16(23)27-11-18(4)19(5,25)15-9-20(10-17(24)29-15)12(2)8-14(21(18,20)26)28-13(3)22/h12,14-15,25-26H,6-11H2,1-5H3/t12-,14+,15-,18-,19+,20-,21+/m1/s1

InChIKey: InChIKey=KXTWLLLCANDKEZ-WIEBGDBASA-N

Formula: C21H32O8

Molecular Weight: 412.474797

Exact Mass: 412.209718

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Schmidt, T.J., Schmidt, H.M., Muller, E., Peters, W., Fronczek, F.R., Truesdale, A., Fischer, N.H. J Nat Prod (1998) 61, 230-6

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Prezizaanes; 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) 37.2
2 (CH2) 40
3 (CH) 77.7
4 (C) 86.5
5 (C) 48.2
6 (C) 77.2
7 (CH) 82.8
8 (CH2) 27.6
9 (C) 45.7
10 (CH2) 34.2
11 (C) 171
12 (CH3) 23.4
13 (CH3) 13.5
14 (CH2) 62.9
15 (CH3) 14.3
3a (C) 169.6
3b (CH3) 21.7
14a (C) 173.1
14b (CH2) 36.1
14c (CH2) 18.3
14d (CH3) 13.7