Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C31H48O9/c1-17-8-9-26(3)10-12-28(5)23-21(34)24(35)29(18(2)32)16-40-19(14-20(33)38-6)22(29)27(23,4)11-13-30(28,25(36)39-7)31(26,37)15-17/h8,18-19,21-24,32,34-35,37H,9-16H2,1-7H3/t18?,19-,21+,22+,23+,24+,26-,27+,28-,29-,30+,31+/m1/s1

InChIKey: InChIKey=ROSROLOGQWRCGM-OSOWGFCRSA-N

Formula: C31H48O9

Molecular Weight: 564.708613

Exact Mass: 564.329833

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - González-Cortazar, M., Tortoriello, J., Alvarez, L. Planta Med (2005) 71, 711-6

Species:

Notes: Family : Terpenoids, Type : Triterpenoids, Group : Friedelanes; 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 (CH) 77.61
2 (CH2) 40.96
3 (C) 172.28
4 (CH) 65.32
5 (C) 54.73
6 (CH) 74.21
7 (CH) 68
8 (CH) 52.58
9 (C) 34.12
10 (CH) 57.9
11 (CH2) 41.76
12 (CH2) 23.26
13 (C) 57.7
14 (C) 42.07
15 (CH2) 29.38
16 (CH2) 32.76
17 (C) 37.22
18 (C) 77.16
19 (CH2) 40.41
20 (C) 131.74
21 (CH) 118.91
22 (CH2) 38.73
23 (CH3) 18.24
24 (CH2) 79.69
25 (CH3) 22.81
26 (CH3) 21.46
27 (C) 176.3
28 (CH3) 27
30 (CH3) 23.14
3a (CH3) 52.07
27a (CH3) 51.97