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4474-91-3

4474-91-3 structural image
Product Name: ANGIOTENSIN II, HUMAN
Formula: C50H71N13O12
Synonyms: Ang II;Angiotensin 2;Angiotensin II;Angiotensin II, Human - CAS 4474-91-3 - Calbiochem;DRVYIHPF
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Collision Cross Section 353.79 Ų [M+2H]2+ [CCS Type: DT, Method: stepped-field]

COMPUTED DESCRIPTORS

Molecular Weight 1046.2 g/mol
XLogP3 -1.7
Hydrogen Bond Donor Count 13
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 29
Exact Mass 1045.53451475 g/mol
Monoisotopic Mass 1045.53451475 g/mol
Topological Polar Surface Area 409 Ų
Heavy Atom Count 75
Formal Charge 0
Complexity 1980
Isotope Atom Count 0
Defined Atom Stereocenter Count 9
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Ile(5)-angiotensin II is an angiotensin II that acts on the central nervous system (PDB entry: 1N9V). It has a role as a human metabolite. It is a tautomer of an Ile(5)-angiotensin II dizwitterion.