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Chemical structure of (D-Arg⁰,Hyp³,β-(2-thienyl)-Ala⁵,⁸,D-Phe⁷)-Bradykinin

GA20071

(D-Arg⁰,Hyp³,β-(2-thienyl)-Ala⁵,⁸,D-Phe⁷)-Bradykinin

Also known as (2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S,4R)-1-[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]-4-hydroxypyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-thiophen-2-ylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-3-thiophen-2-ylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid

D-Arg-Arg-Pro-Hyp-Gly-Thi-Ser-D-Phe-Thi-Arg, a potent antagonist of bradykinin· Inhibitor of human urinary kallikrein, Ki 0·5 μM

ChemicalCAS103412-36-8MW1294.53FormulaC56H83N19O13S2
CAS number
103412-36-8
Molecular weight
1294.53
Formula
C56H83N19O13S2
Solubility
Soluble in DMSO
InChIKey
ULGMPJSHNJQEJC-VDMFLOONSA-N
Catalogue number
GA20071
Brand
GLPBIO
Computed properties PubChem CID 128372 · XLogP -6.5 · TPSA 598 Ų · H-bond donors 17
XLogP
-6.5
TPSA
598 Ų
H-bond donors
17
H-bond acceptors
19
Rotatable bonds
36
Heavy atoms
90

SMILES C1C[C@H](N(C1)C(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCCN=C(N)N)N)O)C(=O)NCC(=O)N[C@@H](CC3=CC=CS3)C(=O)N[C@@H](CO)C(=O)N[C@H](CC4=CC=CC=C4)C(=O)N[C@@H](CC5=CC=CS5)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O

Computed descriptors from PubChem (CID 128372), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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