Common Name: Youngiajaponicol A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C23H24O6/c1-11-8-18(28-19(26)9-14-4-6-15(24)7-5-14)21-13(3)23(27)29-22(21)20-12(2)17(25)10-16(11)20/h4-7,12,16,18,20-22,24H,1,3,8-10H2,2H3/t12-,16+,18+,20+,21-,22-/m1/s1
InChIKey: InChIKey=XNEAEFUAGMPWDS-NTPMYZKMSA-N
Formula: C23H24O6
Molecular Weight: 396.433933
Exact Mass: 396.157289
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Chen, W., Liu, Q., Wang, J., Zou, J., Meng, D., Zuo, J., Zhu, X., Zhao, W. Planta Med (2006) 72, 143-50
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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)
Position | PPM |
---|---|
1 (CH) | 40.6 |
2 (CH2) | 42.9 |
3 (C) | 219.3 |
4 (CH) | 46.9 |
5 (CH) | 51.4 |
6 (CH) | 82.1 |
7 (CH) | 46.4 |
8 (CH) | 74.9 |
9 (CH2) | 42.1 |
10 (C) | 143.8 |
11 (C) | 137.5 |
12 (C) | 169.3 |
13 (CH2) | 123.5 |
14 (CH2) | 116.3 |
15 (CH3) | 14.8 |
8a (C) | 171.3 |
8b (CH2) | 40.7 |
8c (C) | 125 |
8d (CH) | 130.8 |
8e (CH) | 115.7 |
8f (C) | 157.1 |
8g (CH) | 115.7 |
8h (CH) | 130.8 |