19-0-Acetylteucryemin

19-0-Acetylteucryemin

Common Name: 19-0-Acetylteucryemin

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C24H30O9/c1-13-8-20(32-15(3)26)23(11-30-14(2)25)18(4-5-19(27)24(23)12-31-24)22(13)9-17(33-21(22)28)16-6-7-29-10-16/h6-7,10,13,17-20,27H,4-5,8-9,11-12H2,1-3H3/t13-,17+,18-,19+,20-,22-,23+,24-/m1/s1

InChIKey: InChIKey=XWQPBOZEAVXNBB-UOIFQFROSA-N

Formula: C24H30O9

Molecular Weight: 462.490528

Exact Mass: 462.188983

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Sattar, E.A., Mossa, J.S., Muhammad, I., Elferaly, F.S. Phytochemistry (1995) 40, 1737-41

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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 (CH2) 22.1
2 (CH2) 31.9
3 (CH) 66
4 (C) 63.9
5 (C) 54.3
6 (CH) 69.6
7 (CH2) 30.6
8 (CH) 33.1
9 (C) 51.7
10 (CH) 47.1
11 (CH2) 45.1
12 (CH) 71.8
13 (C) 125
14 (CH) 107.9
15 (CH) 144.2
16 (CH) 139
17 (CH3) 16
18 (CH2) 45
19 (CH2) 62.2
20 (C) 176.7
6a (C) 170.8
6b (CH3) 21.6
19a (C) 169
19b (CH3) 21.1