NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundPerillaldehyde
NPACT-IdNPACT00850
IUPAC4-prop-1-en-2-ylcyclohexene-1-carbaldehyde
SynonymsPerillyl aldehyde;PERILLALDEHYDE;Perilla aldehyde;Perillal;Perillic aldehyde;l-Perillaldehyde;P-Mentha-1,8-dien-7-al;(-)-Perillaldehyde;1-Perillaldehyde;Dihydrocuminyl aldehyde
PubChem Id16441
ClassTerpenoids
In-vitro anticancer activtiy 1 cancer cell lines
In-Vivo anticancer activtiy No
TargetsRAP1A | RHOA | RHOB |   All | 
Properties Physical   Elemental  Topological
InChi KeyRUMOYJJNUMEFDD-UHFFFAOYSA-N
InChi1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3
SMILESO=CC1=CC[C@@H](CC1)C(=C)C
SMART[H]C([H])=C(C([H])([H])[H])[C@@]1([H])C([H])([H])C([H])=C(C([H])=O)C([H])([H])C1([H])[H]
CAS No.2111-75-3
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   C033342
HIT   -
NCI-60 GI50 data   -
Suppliers ABI Chem, ChemFrog, ChemMol, IS Chemical Technology, Jamson Pharmachem Technology, R&D Chemicals, TCI (Tokyo Chemical Industry), 
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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