17-Hydroxyhypoestenone

17-Hydroxyhypoestenone

Common Name: 17-Hydroxyhypoestenone

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H28O3/c1-11(2)14-8-19(23)20(4)9-16-12(3)18(22)7-15(16)13(10-21)5-6-17(14)20/h5,11,14-15,17,21H,6-10H2,1-4H3/b13-5-/t14-,15-,17+,20-/m0/s1

InChIKey: InChIKey=GINPPCDWWHKBBC-STXAEMFASA-N

Formula: C20H28O3

Molecular Weight: 316.435274

Exact Mass: 316.203845

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - El Sayed, K.A. J Nat Prod (2001) 64, 373-5

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Fusicoccanes; 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 (C) 50
2 (CH2) 36.7
3 (C) 171.5
4 (C) 138.5
5 (C) 209.5
6 (CH2) 36.8
7 (CH) 42.8
8 (C) 137
9 (CH) 131.6
10 (CH2) 26.5
11 (CH) 54.9
12 (CH) 44.8
13 (CH2) 42.5
14 (C) 220
15 (CH3) 17.1
16 (CH3) 8.7
17 (CH2) 64.5
18 (CH) 31.5
19 (CH3) 23.7
20 (CH3) 24