NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound12-beta,21-dihydroxycimigenol 3-O-alpha-L-arabinopyranoside
NPACT-IdNPACT01522
IUPAC-
Synonyms-
PubChem Id11856500
ClassTerpenoids
In-vitro anticancer activtiy 1 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyHQKSHPGREYROJL-RWAWCFEYSA-N
InChi1S/C35H56O11/c1-29(2)19-7-8-20-31(5)28(41)35-25(16(13-36)11-18(45-35)26(46-35)30(3,4)42)32(31,6)21(38)12-34(20)15-33(19,34)10-9-22(29)44-27-24(40)23(39)17(37)14-43-27/h16-28,36-42H,7-15H2,1-6H3/t16-,17-,18?,19?,20?,21?,22-,23-,24+,25?,26+,27+,28+,31+,32+,
SMILESO1[C@]23O[C@H](C1C[C@H](C2[C@@]1([C@](C2C4(C5(C4)C(CC2)C([C@@H](O[C@H]2OC[C@H](O)[C@H](O)[C@H]2O)CC5)(C)C)CC1O)([C@H]3O)C)C)CO)C(O)(C)C
SMART[#6]C([#6])(O)[C@@H]1O[C@@]23OC1C[C@@H](CO)C2[C@@]1([#6])C(O)CC24CC22CC[C@H](O[C@H]5OC[C@H](O)[C@H](O)[C@H]5O)C([#6])([#6])C2CCC4[C@]1([#6])[C@H]3O
CAS No.-
Structure
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Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   No
Ghose filter   No
Veber filter   No
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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