supinoxin (CHEBI:749752)

CHEBI:749752 - supinoxin

Formula	C22H24FN5O4
Net Charge	0
Average Mass	441.463
Monoisotopic Mass	441.18123
SMILES	COc1cc(OC)cc(N2CCN(C(=O)Nc3nc4cc(F)ccc4nc3OC)CC2)c1
InChI	InChI=1S/C22H24FN5O4/c1-30-16-11-15(12-17(13-16)31-2)27-6-8-28(9-7-27)22(29)26-20-21(32-3)25-18-5-4-14(23)10-19(18)24-20/h4-5,10-13H,6-9H2,1-3H3,(H,24,26,29)
InChIKey	KAKPGJJRYRYSTP-UHFFFAOYSA-N

ChEBI Ontology

Outgoing Relation(s)
	supinoxin (CHEBI:749752) has role antineoplastic agent (CHEBI:35610)
	supinoxin (CHEBI:749752) is a organic molecular entity (CHEBI:50860)
	supinoxin (CHEBI:749752) is a piperazines (CHEBI:26144)

Citations