-ISIS- 05031710462D
36 40 0 0 0 0 0 0 0 0999 V2000
6.7417 -6.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.7417 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5458 -7.9917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
8.3500 -7.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
8.3500 -6.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.5458 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1542 -7.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
9.9583 -7.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9583 -6.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
9.1542 -6.1375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
10.7625 -5.2083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
9.9583 -4.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1542 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5667 -5.6708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
10.7625 -7.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3500 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0125 -8.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0833 -8.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3500 -8.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1542 -7.0625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9375 -6.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.7625 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.2208 -6.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12.3708 -5.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1375 -6.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.3333 -6.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5292 -6.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.5292 -7.5292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.3333 -7.9917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.1375 -7.5292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.7250 -6.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9208 -6.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9375 -7.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3333 -8.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7250 -7.9917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.1542 -8.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
6 1 1 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 10 1 0 0 0 0
14 15 1 0 0 0 0
5 16 1 6 0 0 0
3 17 1 6 0 0 0
3 18 1 1 0 0 0
4 19 1 1 0 0 0
10 20 1 1 0 0 0
1 21 1 1 0 0 0
11 22 1 6 0 0 0
9 22 1 6 0 0 0
11 14 1 0 0 0 0
9 15 1 0 0 0 0
14 23 1 6 0 0 0
14 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
30 25 1 0 0 0 0
25 21 1 1 0 0 0
27 31 1 1 0 0 0
31 32 1 0 0 0 0
30 33 1 6 0 0 0
29 34 1 1 0 0 0
28 35 1 6 0 0 0
7 36 1 1 0 0 0
M END
> <Catalog No.>
CFN98893
> <Name>
Creticoside C
> <CAS Number>
53452-34-9
> <Purity>
98%
> <Formula>
C26H44O8
> <Mol Weight>
484.6
> <Physical Description>
Powder
> <Type of Compound>
Diterpenoids
> <Solvent>
Pyridine, Methanol, Ethanol, etc.
> <WebLink>
http://www.chemfaces.com/natural/Creticoside-C-CFN98893.html
$$$$