Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C41H70O14/c1-21(17-42)8-7-13-40(6,51)23-11-15-39(5)22(23)9-10-26-38(4)14-12-29(37(2,3)27(38)16-28(46)41(26,39)20-44)54-36-34(32(49)31(48)25(18-43)53-36)55-35-33(50)30(47)24(45)19-52-35/h8,22-36,42-51H,7,9-20H2,1-6H3/b21-8+/t22-,23+,24+,25-,26-,27+,28+,29+,30+,31-,32+,33-,34-,35+,36+,38-,39-,40+,41+/m1/s1

InChIKey: InChIKey=QYSPKCFUBCTSNU-XGXLZXSHSA-N

Formula: C41H70O14

Molecular Weight: 786.987694

Exact Mass: 786.476557

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Liu, W.Y., Zhang, W.D., Chen, H.S., Gu, Z.B., Li, T.Z., Chen, W.S. Planta Med (2004) 70, 458-64

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) 39.7
2 (CH2) 27.1
3 (CH) 88.8
4 (C) 39.8
5 (CH) 54.8
6 (CH2) 30.2
7 (CH) 78.2
8 (C) 49.4
9 (CH) 52.1
10 (C) 37.5
11 (CH2) 23
12 (CH2) 28.3
13 (CH) 44.7
14 (C) 50.4
15 (CH2) 36.6
16 (CH2) 25.8
17 (CH) 49.5
18 (CH2) 61.8
19 (CH3) 16.9
20 (C) 74.4
21 (CH3) 26.5
22 (CH2) 41.5
23 (CH2) 23
24 (CH) 125.7
25 (C) 136.1
26 (CH2) 68.2
27 (CH3) 14.1
28 (CH3) 28
29 (CH3) 16.7
30 (CH3) 17
1' (CH) 105.2
2' (CH) 83.9
3' (CH) 78.2
4' (CH) 71.7
5' (CH) 78.2
6' (CH2) 63
1'' (CH) 106.7
2'' (CH) 73.8
3'' (CH) 74.3
4'' (CH) 69.2
5'' (CH2) 67.1