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Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- structure
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Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-

TL;DR: Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- (CAS 132488-66-5) is a chemical compound with molecular formula C61H88N18O14 and molecular weight 1296.6727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-3-(1-oxidopyridin-1-ium-4-yl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid

Also Known As: 4-Poa-ang I, beta-(4-Pyridyl-1-oxide)-4-ala-angiotensin I, Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-, Angiotensin I, (beta-(4-pyridyl-1-oxide)-alanine(4))-, (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-hydroxy-4-oxobutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-3-(1-oxidopyridin-1-ium-4-yl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid

CAS Number
132488-66-5
Molecular Formula
C61H88N18O14
Molecular Weight
1296.6727 g/mol
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Technical Specifications

Molecular FormulaC61H88N18O14
Molecular Weight1296.6727 g/mol
XLogP-2.8
Topological Polar Surface Area (TPSA)501.0 Ų
Hydrogen Bond Donors15
Hydrogen Bond Acceptors18
Rotatable Bonds37
Exact Mass1296.6727 Da
Heavy Atoms93
Complexity2550.0
SMILESCC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CN=CN1)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CC4=CN=CN4)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H](CC5=CC=[N+](C=C5)[O-])NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)O)N
InChIKeyZWDBRXIZWWUABP-ZBBHJLCNSA-N

Chemical Property Profile of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-

XLogP
-2.8
TPSA (Topological Polar Surface Area)
501.0
Hydrogen Bond Donors
15
Hydrogen Bond Acceptors
18
Rotatable Bonds
37
Heavy Atoms
93
Complexity
2550.0
Exact Mass
1296.6727
Monoisotopic Mass
1296.6727
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-

The XLogP value of -2.8 indicates that Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 501.0 Ų indicates high polarity, suggesting Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- has 15 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-?

The CAS number of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- is 132488-66-5.

What is the molecular formula of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-?

The molecular formula of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- is C61H88N18O14.

What is the molecular weight of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-?

The molecular weight of Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- is 1296.6727 g/mol.

Where can I buy Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-?

You can request a quote for Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))-?

Yes, CoreyChem provides custom synthesis services for Angiotensin I, (beta-(4-pyridyl-1-oxide)-ala(4))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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