Dermorphin

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Systematic / IUPAC Name: L-Tyrosyl-D-alanyl-L-phenylalanylglycyl-L-tyrosyl-L-prolyl-L-serinamide

ID: Reference7255

Other Names: H-Tyr-D-Ala-Phe-Gly-Tyr-Pro-Ser-NH2;
(S)-1-[(S)-2-[2-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-propionylamino}-3-phenyl-propionylamino)-acetylamino]-3-(4-hydroxy-phenyl)-propionyl]-pyrrolidine-2-carboxylic acid ((S)-1-carbamoyl-2-hydroxy-ethyl)-amide;
Tyrosyl-alanyl-phenylalanyl-glycyl-tyrosyl-prolyl-serinamide

Formula: C40H50N8O10

Class: Sports Doping Drugs

Spectral Data

Dermorphin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 311
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/12/2018 11:47:14 AM
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Identificators

InChI InChI=1S/C40H50N8O10/c1-23(44-37(55)29(41)18-25-9-13-27(50)14-10-25)36(54)46-30(19-24-6-3-2-4-7-24)38(56)43-21-34(52)45-31(20-26-11-15-28(51)16-12-26)40(58)48-17-5-8-33(48)39(57)47-32(22-49)35(42)53/h2-4,6-7,9-16,23,29-33,49-51H,5,8,17-22,41H2,1H3,(H2,42,53)(H,43,56)(H,44,55)(H,45,52)(H,46,54)(H,47,57)/t23-,29+,30+,31+,32+,33+/m1/s1
InChI Key FHZPGIUBXYVUOY-VWGYHWLBSA-N
Canonical SMILES CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NCC(=O)NC(CC2=CC=C(C=C2)O)C(=O)N3CCCC3C(=O)NC(CO)C(=O)N)NC(=O)C(CC4=CC=C(C=C4)O)N
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Other Names H-Tyr-D-Ala-Phe-Gly-Tyr-Pro-Ser-NH2;
(S)-1-[(S)-2-[2-((S)-2-{(R)-2-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-propionylamino}-3-phenyl-propionylamino)-acetylamino]-3-(4-hydroxy-phenyl)-propionyl]-pyrrolidine-2-carboxylic acid ((S)-1-carbamoyl-2-hydroxy-ethyl)-amide;
Tyrosyl-alanyl-phenylalanyl-glycyl-tyrosyl-prolyl-serinamide

In Other Databases

KEGG C20030
ChemIDPlus 077614165
ChEMBL CHEMBL278789
ChemSpider 4588650
PubChem 5485199
Wikipedia Dermorphin