Compound	Amooranin
NPACT-Id	NPACT00259
IUPAC	(2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile
Synonyms	Amorinin
PubChem Id	42607999
Class	Terpenoids
In-vitro anticancer activity	3 cancer cell lines
In-Vivo anticancer activity	No
Targets	BCL2 \| BCL2L1 \| CYCS \| All \|
Properties	Physical Elemental Topological
InChi Key	XESZEJDJGPNKIH-UHFFFAOYSA-N
InChi	1S/C30H34O6/c1-16(2)7-9-20-26(33)21(10-8-17(3)4)29-25(27(20)34)22(31)15-24(35-29)19-13-18-11-12-30(5,6)36-28(18)23(32)14-19/h7-8,11-14,24,32-34H,9-10,15H2,1-6H3
SMILES	O1[C@H](CC(=O)c2c1c(c(O)c(c2O)CC=C(C)C)CC=C(C)C)c1cc2c(OC(C=C2)(C)C)c(O)c1
SMART	[H]OC1=C([H])C(=C([H])C2=C1O[C@@](C([H])=C2[H])(C([H])([H])[H])C([H])([H])[H])[C@]1([H])OC2=C(C(O[H])=C(C(O[H])=C2C(=O)C1([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H]
CAS No.	-
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C453733
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	NA,
Drug-Likeliness Filters	Lipinski's rule of five	No
	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