Compound	Pelargonidin
NPACT-Id	NPACT00847
IUPAC	2-(4-hydroxyphenyl)chromenylium-3,5,7-triol
Synonyms	Pelargonidol chloride
PubChem Id	440832
Class	Flavonoid
In-vitro anticancer activity	1 cancer cell lines
In-Vivo anticancer activity	No
Targets	COX-1 \| COX-2 \| All \|
Properties	Physical Elemental Topological
InChi Key	XVFMGWDSJLBXDZ-UHFFFAOYSA-O
InChi	1S/C15H10O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-7H,(H3-,16,17,18,19)/p+1
SMILES	[o+]1c2c(cc(O)c1c1ccc(O)cc1)c(O)cc(O)c2
SMART	OC1=CC=C(C=C1)C1=[O+]C2=CC(O)=CC(O)=C2C=C1O
CAS No.	134-04-3
Structure Download
Cross Refrence in other databases
	Super Natural	000134043
	CTD	C066957
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, Amadis Chemical, ZINC,
Drug-Likeliness Filters	Lipinski's rule of five	Yes
	Ghose filter	Yes
	Veber filter	Yes
	Muegge Filter	Yes
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase