Compound	Curcumin
NPACT-Id	NPACT00463
IUPAC	(2R,6aS)-2,5-dimethyl-10-methylidene-7-prop-1-en-2-yl-3,6a,7,8,9,10a-hexahydro-2H-benzo[h]azulene-1,4-dione
Synonyms	Diferuloylmethane; Turmeric yellow; Kacha haldi; Gelbwurz; Turmeric; Curcuma; Haldar; Souchet; Haidr; Halad; Halud; Indian saffron; Merita earth; Yellow Ginger; Terra Merita; Yellow Root; Curcumin I; Yo-Kin; Hydrastis; Indian turmeric; Tumeric yellow; Yellow puccoon; Golden seal; Diferaloylmethane; Orange Root; kachs haldi; safra d'inde
PubChem Id	969516
Class	Flavonoid
In-vitro anticancer activity	5 cancer cell lines
In-Vivo anticancer activity	Yes
Targets	AR \| BCL2 \| BCL2L1 \| CASP3 \| CASP8 \| COX-2 \| DUSP10 \| JUN \| MMP14 \| MMP2 \| NFKB1 \| NFKBIA \| PARP1 \| PTK2 \| All \|
Properties	Physical Elemental Topological
InChi Key	VFLDPWHFBUODDF-FCXRPNKRSA-N
InChi	1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+
SMILES	O(c1cc(ccc1O)/C=C/C(=O)CC(=O)/C=C/c1cc(OC)c(O)cc1)C
SMART	[H]OC1=C(OC([H])([H])[H])C([H])=C(C([H])=C(/[H])C(=O)C([H])([H])C(=O)C([H])=C(/[H])C2=C([H])C(OC([H])([H])[H])=C(O[H])C([H])=C2[H])C([H])=C1[H]
CAS No.	458-37-7
Structure Download
Cross Refrence in other databases
	Super Natural	000458377
	CTD	D003474
	HIT	C0431
	NCI-60 GI₅₀ data	458-37-7
Suppliers	ABI Chem, AKos Consulting & Solutions, Ambinter, ChemExper Chemical Directory, ChemMol, Hangzhou APIChem Technology, IS Chemical Technology, MolPort, R&D Chemicals, Sigma-Aldrich, TCI (Tokyo Chemical Industry), TimTec, 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

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Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase

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