Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C48H78O20/c1-21(2)9-8-15-48(62,24-12-17-45(5)23(24)10-11-27-44(4)16-14-29(50)47(7,42(59)60)28(44)13-18-46(27,45)6)43(61)68-41-38(67-40-37(58)34(55)31(52)25(19-49)65-40)35(56)32(53)26(66-41)20-63-39-36(57)33(54)30(51)22(3)64-39/h9,22-41,49-58,62H,8,10-20H2,1-7H3,(H,59,60)/t22-,23+,24-,25+,26+,27+,28+,29-,30-,31+,32+,33+,34-,35-,36+,37+,38+,39+,40-,41-,44+,45+,46+,47+,48-/m0/s1

InChIKey: InChIKey=GVANFJOCPNZEGG-ZADZCFRISA-N

Formula: C48H78O20

Molecular Weight: 975.1228

Exact Mass: 974.508645

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Yang, Z., Chen, Q., Hu, L. Phytochemistry (2007) 68, 1752-61

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) 40.2
2 (CH2) 26.3
3 (CH) 78.6
4 (C) 49.7
5 (CH) 57.6
6 (CH2) 21
7 (CH2) 36.3
8 (C) 41.1
9 (CH) 50.9
10 (C) 38.3
11 (CH2) 22.7
12 (CH2) 24.5
13 (CH) 41.7
14 (C) 50.7
15 (CH2) 31.2
16 (CH2) 29.6
17 (CH) 49.1
18 (CH3) 16.9
19 (CH3) 15
20 (C) 79.5
21 (C) 176.4
22 (CH2) 40.4
23 (CH2) 23.4
24 (CH) 125.8
25 (C) 131.7
26 (CH3) 26.2
27 (CH3) 18.3
28 (CH3) 25
29 (C) 181.1
30 (CH3) 16.3
1' (CH) 94.6
2' (CH) 78.8
3' (CH) 78.7
4' (CH) 72.4
5' (CH) 78.3
6' (CH2) 68.2
1'' (CH) 105.6
2'' (CH) 75.7
3'' (CH) 78.7
4'' (CH) 71
5'' (CH) 78.3
6'' (CH2) 63.5
1''' (CH) 102.8
2''' (CH) 72.4
3''' (CH) 73
4''' (CH) 74.2
5''' (CH) 70.1
6''' (CH3) 19