Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C54H92O23/c1-49(2,69-9)14-10-15-54(8,77-47-43(68)39(64)37(62)29(74-47)23-71-45-41(66)34(59)26(58)22-70-45)24-11-17-53(7)33(24)25(57)19-31-51(5)16-13-32(50(3,4)30(51)12-18-52(31,53)6)75-48-44(40(65)36(61)28(21-56)73-48)76-46-42(67)38(63)35(60)27(20-55)72-46/h10,14,24-48,55-68H,11-13,15-23H2,1-9H3/b14-10+/t24-,25+,26-,27+,28+,29+,30-,31+,32-,33-,34-,35+,36+,37+,38-,39-,40-,41+,42+,43+,44+,45-,46-,47-,48-,51-,52+,53+,54-/m0/s1

InChIKey: InChIKey=CCBRDBOHWANETE-YWBWMFLCSA-N

Formula: C54H92O23

Molecular Weight: 1109.296601

Exact Mass: 1108.602939

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Jiang, H.P., Qiu, Y.K., Cheng, D.R., Kang, T.G., Dou, D.Q. Magn Reson Chem (2008) 46, 786-90

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) 39.2
2 (CH2) 26.8
3 (CH) 89
4 (C) 39.7
5 (CH) 56.4
6 (CH2) 18.5
7 (CH2) 35.1
8 (C) 40.1
9 (CH) 50.2
10 (C) 36.9
11 (CH2) 30.6
12 (CH) 70.4
13 (CH) 49.7
14 (C) 51.5
15 (CH2) 30.9
16 (CH2) 26.5
17 (CH) 51.8
18 (CH3) 17.3
19 (CH3) 16.6
20 (C) 83.3
21 (CH3) 23.2
22 (CH2) 39.8
23 (CH) 126.8
24 (CH) 138.6
25 (C) 75.1
26 (CH3) 26.5
27 (CH3) 26.1
28 (CH3) 28.1
29 (CH3) 16.6
30 (CH3) 16
1' (CH) 105.2
2' (CH) 83.5
3' (CH) 78
4' (CH) 71.7
5' (CH) 78.2
6' (CH2) 62.7
1'' (CH) 106.1
2'' (CH) 77.2
3'' (CH) 78.3
4'' (CH) 71.7
5'' (CH) 78.4
6'' (CH2) 62.9
1''' (CH) 98.3
2''' (CH) 75.1
3''' (CH) 79
4''' (CH) 72.1
5''' (CH) 76.7
6''' (CH2) 69.1
1'''' (CH) 104.5
2'''' (CH) 71.7
3'''' (CH) 74.1
4'''' (CH) 68.5
5'''' (CH2) 65.5
25a (CH3) 50.4