-ISIS- 05031710462D
40 44 0 0 0 0 0 0 0 0999 V2000
0.9833 -7.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9833 -8.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7875 -8.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.5875 -8.5208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.5875 -7.5958 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
1.7875 -7.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3875 -8.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1875 -8.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1875 -7.5958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.3875 -7.1292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.9917 -7.1292 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.9917 -6.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1875 -5.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3875 -6.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.8708 -7.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4125 -6.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8708 -5.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1583 -5.0417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.5375 -4.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0625 -4.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6792 -5.5333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
8.5833 -5.3417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.9917 -8.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5875 -5.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5875 -6.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3250 -9.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3958 -6.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1875 -6.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3875 -8.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2500 -9.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5875 -9.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1833 -8.9833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.6333 -7.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9792 -7.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5292 -7.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.8708 -4.4625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
9.4917 -5.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.3333 -3.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2167 -3.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0458 -6.1458 0.0000 H 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
9 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 10 1 0 0 0 0
11 15 1 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
17 12 2 0 0 0 0
17 18 1 0 0 0 0
18 19 1 6 0 0 0
18 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
11 23 1 1 0 0 0
14 24 1 1 0 0 0
5 25 1 1 0 0 0
3 26 1 1 0 0 0
21 27 1 1 0 0 0
9 28 1 6 0 0 0
10 29 1 1 0 0 0
3 30 1 6 0 0 0
4 31 1 6 0 0 0
2 32 2 0 0 0 0
27 33 1 0 0 0 0
33 34 1 0 0 0 0
33 35 2 0 0 0 0
22 36 1 0 0 0 0
22 37 1 0 0 0 0
37 36 1 0 0 0 0
36 38 1 0 0 0 0
36 39 1 0 0 0 0
22 40 1 1 0 0 0
M END
> <Catalog No.>
CFN90158
> <Name>
Alisol B acetate
> <CAS Number>
19865-76-0
> <Purity>
98%
> <Formula>
C32H50O5
> <Mol Weight>
514.74
> <Physical Description>
Cryst.
> <Type of Compound>
Triterpenoids
> <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.
> <WebLink>
http://www.chemfaces.com/natural/Alisol-acetate-B-CFN90158.html
$$$$