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DAMGO (TFA)

CAT: 0931-TP1607-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TP1607-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
950492-85-0
Target
Opioid Receptor
Related Pathways
GPCR/G Protein, Endocrinology/Hormones, Neuroscience
Bioactivity
DAMGO is a selective peptide agonist of the μ-opioid receptor .
Smiles
OC(=O)C(F)(F)F.C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO
Molecular Formula
C28H36F3N5O8
Molecular Weight
627.61
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Damgo (tfa)

See also: Damgo (annotation moved to).

CAS Number950492-85-0
PubChem CID16757018
IUPAC Name(2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-(2-hydroxyethylamino)-1-oxo-3-phenylpropan-2-yl]-methylamino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide;2,2,2-trifluoroacetic acid
Molecular FormulaC28H36F3N5O8
Molecular Weight627.6
Topological Polar Surface Area211
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count13
Heavy Atom Count44
Formal Charge0
Complexity835
SMILES
C[C@H](C(=O)NCC(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)NCCO)NC(=O)[C@H](CC2=CC=C(C=C2)O)N.C(=O)(C(F)(F)F)O
InChI
InChI=1S/C26H35N5O6.C2HF3O2/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18;3-2(4,5)1(6)7/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36);(H,6,7)/t17-,21+,22+;/m1./s1
InChIKey
NIGIQPUQVVEMTD-NJUGUJQKSA-N
Chemical Structure
2D Structure
2D structure of Damgo (tfa)
CAS: 950492-85-0
CID: 16757018
Formula: C28H36F3N5O8
MW: 627.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight627.6
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count13
Exact Mass627.25159761
Monoisotopic Mass627.25159761
Topological Polar Surface Area211 Ų
Heavy Atom Count44
Formal Charge0
Complexity835
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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