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Dynorphin (1-6)

CAT: 0931-TP2949-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TP2949-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
82008-60-4
Bioactivity
Dynorphin (1-6) is a naturally occurring opioid peptide.
Smiles
[C@H](CC1=CC=CC=C1)(C(N[C@H](C(N[C@H](CCCNC(=N)N)C(O)=O)=O)CC(C)C)=O)NC(CNC(CNC([C@H](CC2=CC=C(O)C=C2)N)=O)=O)=O
Molecular Formula
C34H49N9O8
Molecular Weight
711.81
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dynorphin (1-6)

RN given refers to (L-Tyr-L-Phe-L-Leu-D-Arg)-isomer

CAS Number82008-60-4
PubChem CID21120121
IUPAC Name(2R)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Molecular FormulaC34H49N9O8
Molecular Weight711.8
XLogP-3.8
Topological Polar Surface Area293
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count10
Rotatable Bond Count21
Heavy Atom Count51
Formal Charge0
Complexity1180
SMILES
CC(C)C[C@@H](C(=O)N[C@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@H](CC2=CC=C(C=C2)O)N
InChI
InChI=1S/C34H49N9O8/c1-20(2)15-26(31(48)42-25(33(50)51)9-6-14-38-34(36)37)43-32(49)27(17-21-7-4-3-5-8-21)41-29(46)19-39-28(45)18-40-30(47)24(35)16-22-10-12-23(44)13-11-22/h3-5,7-8,10-13,20,24-27,44H,6,9,14-19,35H2,1-2H3,(H,39,45)(H,40,47)(H,41,46)(H,42,48)(H,43,49)(H,50,51)(H4,36,37,38)/t24-,25+,26-,27-/m0/s1
InChIKey
ILBHHEXPXBRSKB-XUJYPJAKSA-N
Chemical Structure
2D Structure
2D structure of Dynorphin (1-6)
CAS: 82008-60-4
CID: 21120121
Formula: C34H49N9O8
MW: 711.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight711.8
XLogP3-3.8
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count10
Rotatable Bond Count21
Exact Mass711.37040956
Monoisotopic Mass711.37040956
Topological Polar Surface Area293 Ų
Heavy Atom Count51
Formal Charge0
Complexity1180
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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