Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C49H78O18/c1-22(2)18-25-19-49(59,44(58)63-25)27-12-16-47(8)26(27)10-11-31-46(7)15-14-32(45(5,6)30(46)13-17-48(31,47)9)65-43-40(67-42-38(57)36(55)33(52)23(3)62-42)39(35(54)29(64-43)21-60-24(4)50)66-41-37(56)34(53)28(51)20-61-41/h18,23,25-43,51-57,59H,10-17,19-21H2,1-9H3/t23-,25+,26?,27-,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38+,39-,40+,41-,42-,43-,46-,47+,48+,49+/m0/s1

InChIKey: InChIKey=AXBJYHWXSQPRFA-GVJFKKTGSA-N

Formula: C49H78O18

Molecular Weight: 955.134726

Exact Mass: 954.518816

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Ying, F., Hu, L.-H. Helv Chim Acta (2005) 88, 1126-34

Species:

Notes: Family : Terpenoids, Type : Triterpenoids, Group : Dammaranes; 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) 39.9
2 (CH2) 26.9
3 (CH) 89.6
4 (C) 39.8
5 (CH) 56.9
6 (CH2) 18.6
7 (CH2) 35.8
8 (C) 40.9
9 (CH) 51.3
10 (C) 37.3
11 (CH2) 21.9
12 (CH2) 26.4
13 (CH) 45.1
14 (C) 50.3
15 (CH2) 31.9
16 (CH2) 28.1
17 (CH) 45.5
18 (CH3) 15.8
19 (CH3) 16.7
20 (C) 81.2
21 (C) 178.4
22 (CH2) 39.2
23 (CH) 75.3
24 (CH) 124.1
25 (C) 139.6
26 (CH3) 18.3
27 (CH3) 25.7
28 (CH3) 28
29 (CH3) 16.9
30 (CH3) 16.4
1' (CH) 105.1
2' (CH) 76.8
3' (CH) 87.9
4' (CH) 70
5' (CH) 74.5
6' (CH2) 64.2
7' (C) 170.8
8' (CH3) 20.9
1'' (CH) 101.9
2'' (CH) 72.6
3'' (CH) 72.4
4'' (CH) 74
5'' (CH) 70
6'' (CH3) 18.7
1''' (CH) 105
2''' (CH) 74.9
3''' (CH) 78.4
4''' (CH) 70.7
5''' (CH2) 67.4