Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C35H58O8/c1-18(36)31(4)13-14-33(6)27(31)20(38)16-35(8)28(33)19(37)15-23-32(5)11-10-24(30(2,3)22(32)9-12-34(23,35)7)43-29-26(41)25(40)21(39)17-42-29/h19-29,37-41H,9-17H2,1-8H3/t19-,20+,21-,22+,23-,24+,25+,26-,27+,28-,29+,31+,32+,33+,34-,35-/m1/s1
InChIKey: InChIKey=RUBWFSWHBDUDHT-DDFKDTJXSA-N
Formula: C35H58O8
Molecular Weight: 606.83156
Exact Mass: 606.413169
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Sahu, N.P., Koike, K., Banerjee, S., Achari, B., Nikaido, T. Phytochemistry (2001) 58, 1177-82
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Hopanes; 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) | 38.1 |
2 (CH2) | 25.8 |
3 (CH) | 87.5 |
4 (C) | 38.7 |
5 (CH) | 54.7 |
6 (CH2) | 17.8 |
7 (CH2) | 32.7 |
8 (C) | 44.6 |
9 (CH) | 48 |
10 (C) | 36.1 |
11 (CH2) | 31.7 |
12 (CH) | 67.2 |
13 (CH) | 54.4 |
14 (C) | 40.8 |
15 (CH2) | 44.2 |
16 (CH) | 64 |
17 (CH) | 62.8 |
18 (C) | 45.9 |
19 (CH2) | 45.5 |
20 (CH2) | 36.6 |
21 (C) | 52.1 |
22 (C) | 213.6 |
23 (CH3) | 27.4 |
24 (CH3) | 16.1 |
25 (CH3) | 15.5 |
26 (CH3) | 16.5 |
27 (CH3) | 18.4 |
28 (CH3) | 17.1 |
29 (CH3) | 20 |
30 (CH3) | 25.7 |
1' (CH) | 106 |
2' (CH) | 73.7 |
3' (CH) | 76.7 |
4' (CH) | 69.5 |
5' (CH2) | 65.5 |