NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compound(1S,5S,6R,7R,8S,10S)-5-Angeloyloxy-1,8-dihydroxy-2-oxoxantha-3,11-dien-6,12-olide
NPACT-IdNPACT01453
IUPAC-
Synonyms-
PubChem Id-
ClassTerpenoids
In-vitro anticancer activtiy 5 cancer cell lines
In-Vivo anticancer activtiy No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyHJXOXGRXNRMHTP-SSWJCZHDSA-N
InChi1S/C20H26O7/c1-6-8-14(22)20(25)11(4)9-13(21)15-12(5)19(24)26-16(15)17(20)27-18(23)10(3)7-2/h6-8,11,13,15-17,21,25H,5,9H2,1-4H3/b8-6+,10-7-/t11-,13-,15?,16+,17-,20?/m0/s1
SMILES[C@H]1(C([C@H]([C@H]2C([C@H]([CH]1)O)C(=C)C(=O)O2)OC(=O)/C(=CC)/C)(C(=O)/C=C/C)O)C
SMART[H]C1[C@H](O)C2[C@@H](OC(=O)C2=C)[C@H](OC(=O)C([#6])=C/[#6])C(O)([C@H]1[#6])C(=O)C=C[#6]
CAS No.-
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
Suppliers NA, 
Drug-Likeliness Filters Lipinski's rule of five   Yes
Ghose filter   Yes
Veber filter   Yes
Muegge Filter   Yes
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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