1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

hydroxy(oxo)iron;iron

2.1.2 InChI

InChI=1S/3Fe.2H2O.2O/h;;;2*1H2;;/q;2*+1;;;;/p-2

2.1.3 InChI Key

UCNNJGDEJXIUCC-UHFFFAOYSA-L

2.1.4 Canonical SMILES

O[Fe]=O.O[Fe]=O.[Fe]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Bcp30643

2.3 Create Date

2011-02-18

3 Chemical and Physical Properties

Molecular Formula	Fe₃H₂O₄
Molecular Weight	233.55 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	233.800115 g/mol
Monoisotopic Mass	233.800115 g/mol
Topological Polar Surface Area	74.6 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	10.3
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	3

4 Drug and Medication Information

4.1 Drug Information

1 of 2
Drug Name	Feraheme
PubMed Health	Parenteral Mineral/Trace Mineral Combination (Injection)
Drug Classes	Anticonvulsant, Laxative, Hyperosmotic, Nutritive Agent, Parenteral Mineral-Trace Mineral, Renal-Urologic Agent
Drug Label	Feraheme, an iron replacement product, is a non-stoichiometric magnetite (superparamagnetic iron oxide) coated with polyglucose sorbitol carboxymethylether. The overall colloidal particle size is 17-31 nm in diameter. The chemical formula of Feraheme...
Active Ingredient	Ferumoxytol
Dosage Form	Solution
Route	Intravenous
Strength	eq 510mg iron/17ml (eq 30mg iron/ml)
Market Status	Prescription
Company	Amag Pharms

2 of 2
Drug Name	Feraheme
PubMed Health	Parenteral Mineral/Trace Mineral Combination (Injection)
Drug Classes	Anticonvulsant, Laxative, Hyperosmotic, Nutritive Agent, Parenteral Mineral-Trace Mineral, Renal-Urologic Agent
Drug Label	Feraheme, an iron replacement product, is a non-stoichiometric magnetite (superparamagnetic iron oxide) coated with polyglucose sorbitol carboxymethylether. The overall colloidal particle size is 17-31 nm in diameter. The chemical formula of Feraheme...
Active Ingredient	Ferumoxytol
Dosage Form	Solution
Route	Intravenous
Strength	eq 510mg iron/17ml (eq 30mg iron/ml)
Market Status	Prescription
Company	Amag Pharms

Cytogen