Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C43H70O15/c1-22(18-44)9-8-14-42(7,53)25-12-16-41(6)24(25)10-11-28-40(5)15-13-31(39(3,4)29(40)17-30(48)43(28,41)21-46)57-38-36(34(51)32(49)26(19-45)56-38)58-37-35(52)33(50)27(20-54-37)55-23(2)47/h9,21,24-38,44-45,48-53H,8,10-20H2,1-7H3/b22-9+/t24-,25+,26-,27+,28-,29+,30+,31+,32-,33+,34+,35-,36-,37+,38+,40-,41-,42+,43+/m1/s1
InChIKey: InChIKey=RCUWJJRUBJMDAD-XHIGKZHCSA-N
Formula: C43H70O15
Molecular Weight: 827.00857
Exact Mass: 826.471472
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Liu, W.Y., Zhang, W.D., Chen, H.S., Gu, Z.B., Li, T.Z., Chen, W.S. Planta Med (2004) 70, 458-64
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Dammaranes; 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 (CH2) | 38 |
| 2 (CH2) | 27 |
| 3 (CH) | 88.7 |
| 4 (C) | 39.6 |
| 5 (CH) | 53.8 |
| 6 (CH2) | 30.1 |
| 7 (CH) | 74.6 |
| 8 (C) | 58.5 |
| 9 (CH) | 52.1 |
| 10 (C) | 37.4 |
| 11 (CH2) | 22.7 |
| 12 (CH2) | 27.6 |
| 13 (CH) | 44.3 |
| 14 (C) | 49.9 |
| 15 (CH2) | 36.8 |
| 16 (CH2) | 25.4 |
| 17 (CH) | 48.8 |
| 18 (CH) | 212.2 |
| 19 (CH3) | 16.4 |
| 20 (C) | 74.2 |
| 21 (CH3) | 26.2 |
| 22 (CH2) | 41.4 |
| 23 (CH2) | 22.9 |
| 24 (CH) | 125.6 |
| 25 (C) | 136.1 |
| 26 (CH2) | 68.2 |
| 27 (CH3) | 14 |
| 28 (CH3) | 27.9 |
| 29 (CH3) | 16.4 |
| 30 (CH3) | 16.5 |
| 1' (CH) | 105.1 |
| 2' (CH) | 83.3 |
| 3' (CH) | 78.2 |
| 4' (CH) | 71.8 |
| 5' (CH) | 78.3 |
| 6' (CH2) | 62.9 |
| 1'' (CH) | 106.5 |
| 2'' (CH) | 74.2 |
| 3'' (CH) | 72.2 |
| 4'' (CH) | 72.4 |
| 5'' (CH2) | 64.6 |
| 4''a (C) | 170.8 |
| 4''b (CH3) | 21.2 |