Common Name: 12β-Hydroxy-1α,6α-diacetoxy-ent-kaura-9(11),16-dien-15-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H32O6/c1-12-15-10-24(21(12)28)11-17(29-13(2)25)20-22(4,5)8-7-19(30-14(3)26)23(20,6)18(24)9-16(15)27/h9,15-17,19-20,27H,1,7-8,10-11H2,2-6H3/t15-,16-,17+,19+,20-,23-,24+/m1/s1
InChIKey: InChIKey=XFKVVBCVBXGLMH-JNEANYDJSA-N
Formula: C24H32O6
Molecular Weight: 416.508195
Exact Mass: 416.219889
NMR Solvent: C+M
MHz:
Calibration:
NMR references: 13C - Qu, J.B., Zhu, R.L., Zhang, Y.L., Guo, H.F., Wang, X.N., Xie, C.F., Yu, W.T., Ji, M., Lou, H.X. J Nat Prod (2008) 71, 1418-22
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 79.3 |
2 (CH2) | 25.8 |
3 (CH2) | 40.1 |
4 (C) | 33.6 |
5 (CH) | 48.5 |
6 (CH) | 68.5 |
7 (CH2) | 35.2 |
8 (C) | 49.7 |
9 (C) | 147.5 |
10 (C) | 42.8 |
11 (CH) | 128.1 |
12 (CH) | 69.8 |
13 (CH) | 42.9 |
14 (CH2) | 42.1 |
15 (C) | 202.7 |
16 (C) | 142.5 |
17 (CH2) | 118.7 |
18 (CH3) | 32.7 |
19 (CH3) | 22.8 |
20 (CH3) | 19.9 |
1a (C) | 171.1 |
1b (CH3) | 21.8 |
6a (C) | 170.4 |
6b (CH3) | 21.7 |