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Compound	Rhyncophylline
NPACT-Id	NPACT00919
IUPAC	methyl(E)-2-[(3R,6'R,7'S,8'aS)-6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate
Synonyms	Rhynchophylline;methyl(E)-2-[(3R,6'R,7'S,8'aS)-6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate
PubChem Id	5281408
Class	Alkaloids
In-vitro anticancer activtiy	1 cancer cell lines
In-Vivo anticancer activtiy	No
Targets	NOS2 \| TNF \| All \|
Properties	Physical Elemental Topological
InChi Key	DAXYUDFNWXHGBE-KAXDATADSA-N
InChi	1S/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22+/m0/s1
SMILES	O=C1Nc2c([C@@]31[C@H]1N(CC3)C[C@@H]([C@H](C1)/C(=COC)/C(=O)OC)CC)cccc2
SMART	[H]N1C(=O)[C@@]2(C3=C([H])C([H])=C([H])C([H])=C13)C([H])([H])C([H])([H])[N@@]1C([H])([H])[C@]([H])(C([H])([H])C([H])([H])[H])[C@@]([H])(C(=C([H])OC([H])([H])[H])C(=O)OC([H])([H])[H])C([H])([H])[C@@]21[H]
CAS No.	76-66-4
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C052714
	HIT	C0077
	NCI-60 GI₅₀ data	-
Suppliers	ABI Chem, Ambinter, Hangzhou Trylead Chemical Technology, IS Chemical Technology,
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