iofolastat (CHEBI:748969)

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CHEBI:748969 - iofolastat

Formula	C19H26IN3O7
Net Charge	0
Average Mass	535.335
Monoisotopic Mass	535.08155
SMILES	O=C(O)CC[C@H](NC(=O)N[C@@H](CCCCNCc1ccc(I)cc1)C(=O)O)C(=O)O
InChI	InChI=1S/C19H26IN3O7/c20-13-6-4-12(5-7-13)11-21-10-2-1-3-14(17(26)27)22-19(30)23-15(18(28)29)8-9-16(24)25/h4-7,14-15,21H,1-3,8-11H2,(H,24,25)(H,26,27)(H,28,29)(H2,22,23,30)/t14-,15-/m0/s1
InChIKey	OXUUJYOSVPMNKP-GJZGRUSLSA-N

ChEBI Ontology

Outgoing Relation(s)
	iofolastat (CHEBI:748969) is a glutamic acid derivative (CHEBI:24315)

Synonym	Source
Iofolastat	ChEMBL

Citations