NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
Compoundbeta-phellandrene
NPACT-IdNPACT01146
IUPAC-
Synonyms2-p-Menthadiene;p-Mentha-1(7),2-diene;Cyclohexene, 3-methylene-6-(1-methylethyl)-;3-Isopropyl-6-methylene-1-cyclohexene;4-Isopropyl-1-methylene-2-cyclohexene;3-Methylene-6-(1-methylethyl)cyclohexene;beta-Phellandrene l-form;
PubChem Id11142
ClassTerpenoids
In-vitro anticancer activity 1 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyLFJQCDVYDGGFCH-UHFFFAOYSA-N
InChi1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8,10H,3,5,7H2,1-2H3
SMILESC1(C(C)C)CCC(=C)C=C1
SMART[H]C([H])=C1C([H])=C([H])[C@]([H])(C([H])([H])C1([H])[H])[C@]([H])(C([H])([H])[H])C([H])([H])[H]
CAS No.555-10-2
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C058582
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, ChemFrog, ChemMol, 
Drug-Likeliness Filters Lipinski's rule of five   Yes
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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