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Cyclo (Phe-Pro)

CAT: 0013-GTR19156096-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156096-04Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Cyclo (Phe-Pro) known as a secondary metabolite of some bacteria and fungi, is also produced by Vibrio vulnificus.
CAS Number
14705-60-3
Product Name Alternative
Cyclo (phenylalanylprolyl) | A-64863
Purity
>98% (HPLC)
Solubility
DMSO:125 mg/mL (511.69 mM; Need ultrasonic)
Smiles
C1CC2C (=O) NC (C (=O) N2C1) CC3=CC=CC=C3
Molecular Formula
C14H16N2O2
Molecular Weight
244.29
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

(3S-trans)-3-benzylhexahydropyrrolo(1,2-a)pyrazine-1,4-dione

Cyclo(D-Phe-L-Pro) is an organonitrogen compound and an organooxygen compound. It is functionally related to an alpha-amino acid.

CAS Number14705-60-3
PubChem CID99895
IUPAC Name3-benzyl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Molecular FormulaC14H16N2O2
Molecular Weight244.29
XLogP1.4
Topological Polar Surface Area49.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity350
SMILES
C1CC2C(=O)NC(C(=O)N2C1)CC3=CC=CC=C3
InChI
InChI=1S/C14H16N2O2/c17-13-12-7-4-8-16(12)14(18)11(15-13)9-10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2,(H,15,17)
InChIKey
QZBUWPVZSXDWSB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (3S-trans)-3-benzylhexahydropyrrolo(1,2-a)pyrazine-1,4-dione
CAS: 14705-60-3
CID: 99895
Formula: C14H16N2O2
MW: 244.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight244.29
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass244.121177757
Monoisotopic Mass244.121177757
Topological Polar Surface Area49.4 Ų
Heavy Atom Count18
Formal Charge0
Complexity350
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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