Spektraris NMR
Oligoporin C
Common Name: Oligoporin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C36H56O10/c1-18(9-8-10-19(2)31(43)44)20-11-14-35(6)27-21(34(5)13-12-25(39)33(3,4)24(34)16-22(27)38)15-26(36(20,35)7)46-32-30(42)29(41)28(40)23(17-37)45-32/h10,18,20,23-26,28-30,32,37,39-42H,8-9,11-17H2,1-7H3,(H,43,44)/b19-10-/t18-,20-,23-,24+,25-,26-,28-,29+,30-,32+,34-,35+,36+/m1/s1
InChIKey: InChIKey=UBNBJPWHWRDJHQ-JOAPMODRSA-N
Formula: C36H56O10
Molecular Weight: 648.825224
Exact Mass: 648.387348
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Lee, I.K., Jang, Y.W., Yu, S.H., Yun, B.S. Bioorg Med Chem Lett (2007) 17, 4906-9
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) | 30.2 |
| 2 (CH2) | 26.4 |
| 3 (CH) | 75.5 |
| 4 (C) | 38.5 |
| 5 (CH) | 45.7 |
| 6 (CH2) | 37.3 |
| 7 (C) | 201.8 |
| 8 (C) | 139 |
| 9 (C) | 169.6 |
| 10 (C) | 41.2 |
| 11 (CH2) | 32.9 |
| 12 (CH) | 77.5 |
| 13 (C) | 50 |
| 14 (C) | 51 |
| 15 (CH2) | 33.6 |
| 16 (CH2) | 24.2 |
| 17 (CH) | 50.3 |
| 18 (CH3) | 12.2 |
| 19 (CH3) | 18.4 |
| 20 (CH) | 33.7 |
| 21 (CH3) | 22.3 |
| 22 (CH2) | 35.3 |
| 23 (CH2) | 29.3 |
| 24 (CH) | 142.9 |
| 25 (C) | 129.2 |
| 26 (CH3) | 21.2 |
| 27 (C) | 172.7 |
| 28 (CH3) | 28.1 |
| 29 (CH3) | 22.3 |
| 30 (CH3) | 25.2 |
| 1' (CH) | 101.2 |
| 2' (CH) | 75.3 |
| 3' (CH) | 78.2 |
| 4' (CH) | 72.3 |
| 5' (CH) | 77.8 |
| 6' (CH2) | 63.5 |
