Compound	Narirutin
NPACT-Id	NPACT00800
IUPAC	-
Synonyms	Isonaringenin
PubChem Id	442431
Class	Flavonoid
In-vitro anticancer activity	4 cancer cell lines
In-Vivo anticancer activity	No
Targets	BAX \| BCL2L1 \| CASP3 \| CCNB1 \| CDC25C \| CDK1 \| PARP1 \| All \|
Properties	Physical Elemental Topological
InChi Key	HXTFHSYLYXVTHC-AJHDJQPGSA-N
InChi	1S/C27H32O14/c1-10-20(31)22(33)24(35)26(38-10)37-9-18-21(32)23(34)25(36)27(41-18)39-13-6-14(29)19-15(30)8-16(40-17(19)7-13)11-2-4-12(28)5-3-11/h2-7,10,16,18,20-29,31-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1
SMILES	O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc1cc2O[C@@H](CC(=O)c2c(O)c1)c1ccc(O)cc1)CO[C@@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C
SMART	[H]OC1=C([H])C([H])=C(C([H])=C1[H])[C@@]1([H])OC2=C([H])C(O[C@]3([H])O[C@]([H])(C([H])([H])O[C@]4([H])O[C@@]([H])(C([H])([H])[H])[C@]([H])(O[H])[C@@]([H])(O[H])[C@@]4([H])O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]3([H])O[H])=C([H])C(O[H])=C2C(=O)C1([H])[H]
CAS No.	14259-46-2
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C500601
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, R&D Chemicals,
Drug-Likeliness Filters	Lipinski's rule of five	No
	Ghose filter	No
	Veber filter	No
	Muegge Filter	No
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase