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Z-Pro-Phe-OH

CAT: 0024-sc-471011Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-471011Size:1 g
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CAS Number
17350-17-3

Chemical Information

1-[(Phenylmethoxy)carbonyl]-L-prolyl-L-phenylalanine
CAS Number17350-17-3
PubChem CID7078922
IUPAC Name(2S)-3-phenyl-2-[[(2S)-1-phenylmethoxycarbonylpyrrolidine-2-carbonyl]amino]propanoic acid
Molecular FormulaC22H24N2O5
Molecular Weight396.4
XLogP3.1
Topological Polar Surface Area95.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity570
SMILES
C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O
InChI
InChI=1S/C22H24N2O5/c25-20(23-18(21(26)27)14-16-8-3-1-4-9-16)19-12-7-13-24(19)22(28)29-15-17-10-5-2-6-11-17/h1-6,8-11,18-19H,7,12-15H2,(H,23,25)(H,26,27)/t18-,19-/m0/s1
InChIKey
GMUYSWQSSRROPG-OALUTQOASA-N
Chemical Structure
2D Structure
2D structure of 1-[(Phenylmethoxy)carbonyl]-L-prolyl-L-phenylalanine
CAS: 17350-17-3
CID: 7078922
Formula: C22H24N2O5
MW: 396.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight396.4
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass396.16852187
Monoisotopic Mass396.16852187
Topological Polar Surface Area95.9 Ų
Heavy Atom Count29
Formal Charge0
Complexity570
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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