Spektraris NMR
14b,15b-Epoxy-3b-hydroxy-9-oxo-11(10f8)-abeolanosta-22-cis,24-trans-dien-26-oic acid
Common Name: 14b,15b-Epoxy-3b-hydroxy-9-oxo-11(10f8)-abeolanosta-22-cis,24-trans-dien-26-oic acid
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H44O5/c1-18(24(33)34)9-8-10-19(2)27(6)17-23-30(35-23)28(27,7)15-13-22(32)29(30)16-11-20-25(3,4)21(31)12-14-26(20,29)5/h8-10,19-21,23,31H,11-17H2,1-7H3,(H,33,34)/b10-8-,18-9+/t19-,20+,21+,23+,26+,27-,28-,29-,30+/m1/s1
InChIKey: InChIKey=UONZCNGOTPYRMX-HEGXSNGOSA-N
Formula: C30H44O5
Molecular Weight: 484.668495
Exact Mass: 484.318875
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Vieira, L.M., Kijjoa, A., Wilairat, R., Nascimento, M.S., Gales, L., Damas, A.M., Silva, A.M., Mondranondra, I.O., Herz, W. J Nat Prod (2004) 67, 2043-7
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lanostanes; 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) | 34.04 |
| 2 (CH2) | 28.16 |
| 3 (CH) | 77.61 |
| 4 (C) | 37.68 |
| 5 (CH) | 49.02 |
| 6 (CH2) | 21.45 |
| 7 (CH2) | 34.22 |
| 8 (C) | 63.59 |
| 9 (C) | 218.3 |
| 10 (C) | 50.26 |
| 11 (CH2) | 39.46 |
| 12 (CH2) | 29.29 |
| 13 (C) | 46.38 |
| 14 (C) | 79.18 |
| 15 (CH) | 57.72 |
| 16 (CH2) | 41.21 |
| 17 (C) | 43.03 |
| 18 (CH3) | 21.27 |
| 19 (CH3) | 14.53 |
| 20 (CH) | 39.14 |
| 21 (CH3) | 17.55 |
| 22 (CH) | 141.32 |
| 23 (CH) | 122.52 |
| 24 (CH) | 131.34 |
| 25 (C) | 128.35 |
| 26 (C) | 169.21 |
| 27 (CH3) | 12.39 |
| 28 (CH3) | 29.98 |
| 29 (CH3) | 16.82 |
| 30 (CH3) | 21.8 |
