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PL265

CAT: 0013-GTR19277374Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19277374Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
PL265 is a long-acting dual ENKephalinase inhibitor (DENKi) with analgesic potential.
CAS Number
1206514-62-6
Smiles
C ([C@H] (CP ([C@@H] (NC (OCOC (C (C) C) =O) =O) C) (=O) O) C (N[C@H] (C (O) =O) C) =O) C1=CC=C (C=C1) C2=CC=CC=C2
Molecular Formula
C27H35N2O9P
Molecular Weight
562.55
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Demethyl PL265
CAS Number1206514-62-6
PubChem CID58277249
IUPAC Name(2S)-2-[[(2S)-2-[[hydroxy-[(1R)-1-(2-methylpropanoyloxymethoxycarbonylamino)ethyl]phosphoryl]methyl]-3-(4-phenylphenyl)propanoyl]amino]propanoic acid
Molecular FormulaC27H35N2O9P
Molecular Weight562.5
XLogP3
Topological Polar Surface Area168
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Heavy Atom Count39
Formal Charge0
Complexity882
SMILES
C[C@@H](C(=O)O)NC(=O)[C@H](CC1=CC=C(C=C1)C2=CC=CC=C2)CP(=O)([C@H](C)NC(=O)OCOC(=O)C(C)C)O
InChI
InChI=1S/C27H35N2O9P/c1-17(2)26(33)37-16-38-27(34)29-19(4)39(35,36)15-23(24(30)28-18(3)25(31)32)14-20-10-12-22(13-11-20)21-8-6-5-7-9-21/h5-13,17-19,23H,14-16H2,1-4H3,(H,28,30)(H,29,34)(H,31,32)(H,35,36)/t18-,19+,23+/m0/s1
InChIKey
HLACXNCYLIKGES-YCRNBWNJSA-N
Chemical Structure
2D Structure
2D structure of Demethyl PL265
CAS: 1206514-62-6
CID: 58277249
Formula: C27H35N2O9P
MW: 562.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight562.5
XLogP33
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Exact Mass562.20801770
Monoisotopic Mass562.20801770
Topological Polar Surface Area168 Ų
Heavy Atom Count39
Formal Charge0
Complexity882
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3600755PL265
HY-115851Demethyl PL265

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