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RXP-407

CAT: 0013-GTR19224297-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19224297-02Size:25 mg
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Description
RXP 407 is a selective inhibitor of the N-domain of angiotensin I-converting enzyme. RXP 407 blocks the degradation of hemoregulatory peptide acetyl-Ser-Asp-Lys-Pro with no effect on angiotensin I hydrolysis in vivo.
CAS Number
237770-41-1
Field of Research
Metabolism Research
Smiles
[C@@H] (CC1=CC=CC=C1) (NC ([C@H] (CC (O) =O) NC (C) =O) =O) P (C[C@H] (C (N[C@H] (C (N) =O) C) =O) C) (=O) O
Molecular Formula
C21H31N4O8P
Molecular Weight
498.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Rxp-407

inhibits angiotensin I converting enzyme

CAS Number237770-41-1
PubChem CID9827219
IUPAC Name(3S)-3-acetamido-4-[[(1R)-1-[[(2S)-3-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-2-methyl-3-oxopropyl]-hydroxyphosphoryl]-2-phenylethyl]amino]-4-oxobutanoic acid
Molecular FormulaC21H31N4O8P
Molecular Weight498.5
XLogP-1.6
Topological Polar Surface Area205
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Heavy Atom Count34
Formal Charge0
Complexity815
SMILES
C[C@H](CP(=O)([C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(=O)O)NC(=O)C)O)C(=O)N[C@@H](C)C(=O)N
InChI
InChI=1S/C21H31N4O8P/c1-12(20(30)23-13(2)19(22)29)11-34(32,33)17(9-15-7-5-4-6-8-15)25-21(31)16(10-18(27)28)24-14(3)26/h4-8,12-13,16-17H,9-11H2,1-3H3,(H2,22,29)(H,23,30)(H,24,26)(H,25,31)(H,27,28)(H,32,33)/t12-,13+,16+,17-/m1/s1
InChIKey
OCAZUTUOYLAIOA-OSRSDYAFSA-N
Chemical Structure
2D Structure
2D structure of Rxp-407
CAS: 237770-41-1
CID: 9827219
Formula: C21H31N4O8P
MW: 498.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight498.5
XLogP3-1.6
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Exact Mass498.18795096
Monoisotopic Mass498.18795096
Topological Polar Surface Area205 Ų
Heavy Atom Count34
Formal Charge0
Complexity815
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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