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Chemical structure of (Hyp³)-Bradykinin

GA20221

(Hyp³)-Bradykinin

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

(Hyp³)-Bradykinin, naturally occurring peptide hormone, is a bradykinin receptor agonist

ChemicalCAS37642-65-2MW1076.22FormulaC50H73N15O12
CAS number
37642-65-2
Molecular weight
1076.22
Formula
C50H73N15O12
Solubility
DMSO ： 100 mg/mL (92·92 mM; Need ultrasonic)
InChIKey
JXRLHZCEMXTCBN-DIBGMJQNSA-N
Catalogue number
GA20221
Brand
GLPBIO
Computed properties PubChem CID 169947 · XLogP -5.8 · TPSA 439 Ų · H-bond donors 13
XLogP
-5.8
TPSA
439 Ų
H-bond donors
13
H-bond acceptors
15
Rotatable bonds
27
Heavy atoms
77

SMILES C1C[C@H](N(C1)C(=O)[C@H](CCCN=C(N)N)N)C(=O)N2C[C@@H](C[C@H]2C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)O

Computed descriptors from PubChem (CID 169947), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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