Compound	Bucidarasin B
NPACT-Id	NPACT00349
IUPAC	[(1R,3S,5S,6aR,7S,8S)-1,3-diacetyloxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-5-yl] 2-methylpropanoate
Synonyms	Casearlucin A
PubChem Id	10414276
Class	Terpenoids
In-vitro anticancer activity	13 cancer cell lines
In-Vivo anticancer activity	No
Targets	No targets found
Properties	Physical Elemental Topological
InChi Key	FGGPIWICAGRSLN-JUOLQFDPSA-N
InChi	1S/C29H42O8/c1-9-16(3)11-12-28(8)18(5)13-24(32)29-22(26(34-19(6)30)37-27(29)35-20(7)31)14-21(15-23(28)29)36-25(33)17(4)10-2/h9,11,14,17-18,21,23-24,26-27,32H,1,10,12-13,15H2,2-8H3/b16-11+/t17?,18-,21+,23+,24+,26+,27-,28-,29?/m0/s1
SMILES	O1[C@H](OC(=O)C)[C@]23[C@@H]([C@]([C@H](C[C@H]2O)C)(C/C=C(C)/C=C)C)C[C@H](OC(=O)[C@H](CC)C)C=C3[C@@H]1OC(=O)C
SMART	[#6]C[C@H]([#6])C(=O)O[C@H]1C[C@H]2[C@@]3([C@@H](OC([#6])=O)O[C@@H](OC([#6])=O)C3=C1)[C@H](O)C[C@H]([#6])[C@]2([#6])CC=C(/[#6])C=C
CAS No.	-
Structure Download
Cross Refrence in other databases
	Super Natural	-
	CTD	C456403
	HIT	-
	NCI-60 GI₅₀ data	-
Suppliers	NA,
Drug-Likeliness Filters	Lipinski's rule of five	No
	Ghose filter	No
	Veber filter	No
	Muegge Filter	Yes
Similarity Search	Human metabolite database	FDA approved drugs

NPACT

Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase