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[D-Ala2]-Met-Enkephalin

CAT: 1601-CCP1546-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:1601-CCP1546-01Size:1 mg
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Description
Peptide to [D-Ala2]-Met-Enkephalin
CAS Number
61370-87-4
Structure Composition
Tyr-D-Ala-Gly-Phe-Met
Purity
> 95%
Form
Lyophilized powder
Molecular Formula
C28H37N5O7S
Molecular Weight
587.7
Storage Conditions
Shipped at 4°C. Store at -20°C for one year.
Light Source
Synthetic

Chemical Information

Enkephalin-met, ala(2)-

synthetic analog of methionine enkephalin

CAS Number61370-87-4
PubChem CID5486820
IUPAC Name(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoic acid
Molecular FormulaC28H37N5O7S
Molecular Weight587.7
XLogP-1.7
Topological Polar Surface Area225
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count9
Rotatable Bond Count16
Heavy Atom Count41
Formal Charge0
Complexity878
SMILES
C[C@H](C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)N
InChI
InChI=1S/C28H37N5O7S/c1-17(31-26(37)21(29)14-19-8-10-20(34)11-9-19)25(36)30-16-24(35)32-23(15-18-6-4-3-5-7-18)27(38)33-22(28(39)40)12-13-41-2/h3-11,17,21-23,34H,12-16,29H2,1-2H3,(H,30,36)(H,31,37)(H,32,35)(H,33,38)(H,39,40)/t17-,21+,22+,23+/m1/s1
InChIKey
MHNSNPIYASDSCR-SZOBAZRNSA-N
Chemical Structure
2D Structure
2D structure of Enkephalin-met, ala(2)-
CAS: 61370-87-4
CID: 5486820
Formula: C28H37N5O7S
MW: 587.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight587.7
XLogP3-1.7
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count9
Rotatable Bond Count16
Exact Mass587.24136971
Monoisotopic Mass587.24136971
Topological Polar Surface Area225 Ų
Heavy Atom Count41
Formal Charge0
Complexity878
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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