Compound	Cinnamaldehyde
NPACT-Id	NPACT00422
IUPAC	(E)-3-phenylprop-2-enoic acid
Synonyms	3-Phenylacrylaldehyde; Cinnamal; Phenylacrolein; Zimtaldehyde; Cassia aldehyde; 3-Phenylpropenal; Benzylideneacetaldehyde; Cinnamyl aldehyde; beta-phenylacrolein; Aldehyd skoricovy
PubChem Id	637511
Class	Organic chemical
In-vitro anticancer activity	2 cancer cell lines
In-Vivo anticancer activity	No
Targets	BAX \| BCL2L1 \| FAS \| PARP1 \| TP53 \| All \|
Properties	Physical Elemental Topological
InChi Key	KJPRLNWUNMBNBZ-QPJJXVBHSA-N
InChi	1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+
SMILES	O=C/C=C/c1ccccc1
SMART	[H]C(=O)C([H])=C(/[H])C1=C([H])C([H])=C([H])C([H])=C1[H]
CAS No.	104-55-2
Structure Download
Cross Refrence in other databases
	Super Natural	000104552
	CTD	C012843
	HIT	C0369
	NCI-60 GI₅₀ data	-
Suppliers	AAA Chemistry, ABI Chem, AKos Consulting & Solutions, Amadis Chemical, Ambinter, Angene International, ChemExper Chemical Directory, Chemical Synthesis Database, ChemMol, IS Chemical Technology, MolPort, R&D Chemicals, Sigma-Aldrich, TCI (Tokyo Chemical Industry), Vitas-M Laboratory, ZINC,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	No
	Veber filter	Yes
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase