Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C52H84O22/c1-22(2)14-23-15-50(7,74-43-37(62)32(57)25(56)19-65-43)42-24-8-9-30-48(5)12-11-31(47(3,4)29(48)10-13-49(30,6)51(24)20-52(42,73-23)66-21-51)70-46-41(72-44-38(63)34(59)27(17-54)68-44)40(35(60)28(18-55)69-46)71-45-39(64)36(61)33(58)26(16-53)67-45/h14,23-46,53-64H,8-13,15-21H2,1-7H3/t23?,24-,25+,26-,27+,28-,29+,30-,31+,32+,33-,34+,35-,36+,37-,38-,39-,40+,41-,42-,43+,44+,45+,46+,48+,49-,50+,51+,52+/m1/s1

InChIKey: InChIKey=KKXTYLIJLMOZCW-OZUUQMCISA-N

Formula: C52H84O22

Molecular Weight: 1061.212198

Exact Mass: 1060.545424

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Zhou, Y., Shen, Y.H., Zhang, C., Su, J., Liu, R.H., Zhang, W.D. J Nat Prod (2007) 70, 652-5

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) 38.4
2 (CH2) 26.4
3 (CH) 88.8
4 (C) 39.4
5 (CH) 55.8
6 (CH2) 17.9
7 (CH2) 35.7
8 (C) 37.1
9 (CH) 52.5
10 (C) 36.7
11 (CH2) 21.3
12 (CH2) 28
13 (CH) 35.6
14 (C) 53.4
15 (CH2) 37
16 (C) 109.8
17 (CH) 52.5
18 (CH2) 65.6
19 (CH3) 15.9
20 (C) 75.3
21 (CH3) 24.8
22 (CH2) 41.2
23 (CH) 68.4
24 (CH) 127.1
25 (C) 133.4
26 (CH3) 25.4
27 (CH3) 18
28 (CH3) 27.4
29 (CH3) 16.2
30 (CH3) 18.4
1' (CH) 104.7
2' (CH) 78.8
3' (CH) 88.4
4' (CH) 70
5' (CH) 78.1
6' (CH2) 62.4
1'' (CH) 109.6
2'' (CH) 83.5
3'' (CH) 77.4
4'' (CH) 84.5
5'' (CH2) 61.8
1''' (CH) 104.4
2''' (CH) 75.1
3''' (CH) 77.5
4''' (CH) 71.2
5''' (CH) 78.2
6''' (CH2) 62
1'''' (CH) 98.5
2'''' (CH) 72.7
3'''' (CH) 74.8
4'''' (CH) 69
5'''' (CH2) 66.4