Spektraris NMR
22S)-3b-Hydroxylanosta-8,24-dien-26,22-olide
Common Name: 22S)-3b-Hydroxylanosta-8,24-dien-26,22-olide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H46O3/c1-18-8-10-23(33-26(18)32)19(2)20-12-16-30(7)22-9-11-24-27(3,4)25(31)14-15-28(24,5)21(22)13-17-29(20,30)6/h8,19-20,23-25,31H,9-17H2,1-7H3/t19-,20+,23+,24-,25-,28+,29+,30-/m0/s1
InChIKey: InChIKey=APHQNJVBNMVFGR-OLEJALSGSA-N
Formula: C30H46O3
Molecular Weight: 454.685566
Exact Mass: 454.344695
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Dine, R.S.E., Halawany, A.M.E., Nakamura, N., Ma, C.M., Hattori, M. Chem Pharm Bull (2008) 56, 642-6
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) | 35.4 |
| 2 (CH2) | 27.7 |
| 3 (CH) | 78.8 |
| 4 (C) | 38.8 |
| 5 (CH) | 50.2 |
| 6 (CH2) | 18.2 |
| 7 (CH2) | 26.4 |
| 8 (C) | 134.1 |
| 9 (C) | 134.4 |
| 10 (C) | 36.9 |
| 11 (CH2) | 20.9 |
| 12 (CH2) | 30.7 |
| 13 (C) | 44.4 |
| 14 (C) | 49.8 |
| 15 (CH2) | 30.7 |
| 16 (CH2) | 27.7 |
| 17 (CH) | 45.7 |
| 18 (CH3) | 15.5 |
| 19 (CH3) | 19.1 |
| 20 (CH) | 40.4 |
| 21 (CH3) | 13.3 |
| 22 (CH) | 80.2 |
| 23 (CH2) | 27.7 |
| 24 (CH) | 139.7 |
| 25 (C) | 128.1 |
| 26 (C) | 166.6 |
| 27 (CH3) | 17.1 |
| 28 (CH3) | 27.9 |
| 29 (CH3) | 15.4 |
| 30 (CH3) | 24.3 |
