(Z)-Neomanoalide 24,25-diacetate

(Z)-Neomanoalide 24,25-diacetate

Common Name: (Z)-Neomanoalide 24,25-diacetate

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C29H42O6/c1-20(12-14-26-21(2)10-8-16-29(26,5)6)9-7-11-24(18-33-22(3)30)13-15-27-25(17-28(32)35-27)19-34-23(4)31/h9,13,17,27H,7-8,10-12,14-16,18-19H2,1-6H3/b20-9+,24-13+

InChIKey: InChIKey=HUOUTXIIOOBRPE-SSSKFANLSA-N

Formula: C29H42O6

Molecular Weight: 486.641282

Exact Mass: 486.298139

NMR Solvent: B+B

MHz:

Calibration:

NMR references: 13C - Wonganuchitmeta, S.N., Yuenyongsawad, S., Keawpradub, N., Plubrukarn, A. J Nat Prod (2004) 67, 1767-70

Species:

Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Monocarbocyclics; 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) 170.7
2 (CH) 117.7
3 (C) 164.9
4 (CH) 80.7
5 (CH2) 30.5
6 (CH) 122.4
7 (C) 138.9
8 (CH2) 35.6
9 (CH2) 28.4
10 (CH) 123.4
11 (C) 136.8
12 (CH2) 40.8
13 (CH2) 27
14 (C) 137.3
15 (C) 127.3
16 (CH2) 33
17 (CH2) 20
18 (CH2) 40.2
19 (C) 35.2
20 (CH3) 28.8
21 (CH3) 28.8
22 (CH3) 20
23 (CH3) 16.2
24 (CH2) 61.4
25 (CH2) 59
24a (C) 170.1
24b (CH3) 19.8
25a (C) 169.1
25b (CH3) 20.4