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Angiotensin II, sar(1)-4-azido-phe(8)-

HCID 129011817
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
87262-02-0
Standard SMILES
CCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(N=[N+]=[N-])cc1)C(=O)O
InChIKey
YSHKYBCPLXTHCY-OUZQGACWSA-N
Molecular formula
C49H70N16O10
Average molar mass
1,043.2 g/mol
Monoisotopic mass
1,042.54608249

Names & identifiers

Preferred name
Angiotensin II, sar(1)-4-azido-phe(8)-
IUPAC
(2S)-3-(4-azidophenyl)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(methylamino)acetyl]amino]pentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]propanoic acid
English name
angiotensin II, Sar(1)-4-azido-Phe(8)-
Molecular formula
C49H70N16O10
Molecular weight
1043.1813

Names & synonyms

Azido-sarangSap-aii1-Sar-(4-N3)-8-phe-angiotensin IIAngiotensin II, sar(1)-4-azido-phe(8)-Angiotensin II, sarcosyl(1)-(4-N3)-phenylalanine(8)-87262-02-0RefChem:112701Angiotensin II, 1-(N-methylglycine)-5-L-isoleucine-8-(4-azido-L-phenylalanine)-

Database identifiers

CAS
87262-02-0
PubChem CID
129011817

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
372 Ų
Hydrogen bond donors
12
Hydrogen bond acceptors
15
Rotatable bonds
30
Heavy atoms
75
Formal charge
0
Complexity
1,990

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Compound notes

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