Compound	Rhinacanthin M
NPACT-Id	NPACT00914
IUPAC	[3-(1-hydroxy-3,4-dioxonaphthalen-2-yl)-2,2-dimethylpropyl] benzoate
Synonyms	1,4-naphthalenedione,2-[3-(benzoyloxy)-2,2-dimethylpropyl]-3-hydroxy-;Benzoic acid 3-(3-hydroxy-1,4-dioxo-1,4-dihydro-naphthalen-2-yl)-2,2-dimethyl-propyl ester;3-(3-Hydroxy-1,4-dioxo-1,4-dihydro-2-naphthalenyl)-2,2-dimethylpropyl benzoate
PubChem Id	10808757
Class	Polycyclic aromatic natural products
In-vitro anticancer activity	5 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	IEHVESOICXKEAC-UHFFFAOYSA-N
InChi	1S/C22H20O5/c1-22(2,13-27-21(26)14-8-4-3-5-9-14)12-17-18(23)15-10-6-7-11-16(15)19(24)20(17)25/h3-11,23H,12-13H2,1-2H3
SMILES	O(CC(CC1=C(O)c2c(C(=O)C1=O)cccc2)(C)C)C(=O)c1ccccc1
SMART	[#6][C@]([#6])(COC(=O)C1=CC=CC=C1)CC1=C(O)C2=CC=CC=C2C(=O)C1=O
CAS No.	205653-95-8
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	-
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	NA,
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