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Chemical structure of [Des-Pro2]-Bradykinin

GC76535

[Des-Pro2]-Bradykinin

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

[Des-Pro2]-Bradykinin is a protease inhibitor

ChemicalCAS80943-05-1MW963.09FormulaC45H66N14O10
CAS number
80943-05-1
Molecular weight
963.09
Formula
C45H66N14O10
InChIKey
QFSJEDMTCFOOTJ-POFDKVPJSA-N
Catalogue number
GC76535
Brand
GLPBIO
Computed properties PubChem CID 3086119 · XLogP -4.8 · TPSA 398 Ų · H-bond donors 12
XLogP
-4.8
TPSA
398 Ų
H-bond donors
12
H-bond acceptors
13
Rotatable bonds
26
Heavy atoms
69

SMILES C1C[C@H](N(C1)C(=O)[C@H](CCCN=C(N)N)N)C(=O)NCC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CO)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O

Computed descriptors from PubChem (CID 3086119), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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