Common Name: 6R,8a-Dihydroxycarapin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C27H32O9/c1-24(2)19(18(29)23(32)34-5)26(4)15-6-8-25(3)16(27(15,33)11-14(20(24)30)21(26)31)10-17(28)36-22(25)13-7-9-35-12-13/h7,9-10,12,14-15,18-19,22,29,33H,6,8,11H2,1-5H3/t14-,15+,18+,19-,22-,25+,26+,27+/m0/s1
InChIKey: InChIKey=FCNXONSFUSUPIZ-JPJIMROCSA-N
Formula: C27H32O9
Molecular Weight: 500.538618
Exact Mass: 500.204633
NMR Solvent: C+M
MHz:
Calibration:
NMR references: 13C - Tchimene, M.K., Tane, P., Ngamga, D., Connolly, J.D., Farrugia, L.J. Phytochemistry (2005) 66, 1088-93
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Limonoids; 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 (C) | 216.1 |
2 (CH) | 48.4 |
3 (C) | 212 |
4 (C) | 42.2 |
5 (CH) | 43 |
6 (CH) | 74.3 |
7 (C) | 177.4 |
8 (C) | 73.2 |
9 (CH) | 51.5 |
10 (C) | 53.3 |
11 (CH2) | 20.1 |
12 (CH2) | 28.1 |
13 (C) | 39.9 |
14 (C) | 169.9 |
15 (CH) | 116.6 |
16 (C) | 167.6 |
17 (CH) | 81.4 |
18 (CH3) | 23.5 |
19 (CH3) | 20.6 |
20 (C) | 121.6 |
21 (CH) | 144.8 |
22 (CH) | 112 |
23 (CH) | 143.5 |
28 (CH3) | 21.5 |
29 (CH3) | 23 |
30 (CH2) | 58.4 |
7a (CH3) | 58.4 |