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angiotensin I

Structure via PubChem · Public domain (PubChem)

EntityQ539799· pop 6

angiotensin I

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Also known as ang I, AGT(34-43), angiotensin(34-43), angiotensin-1, angiotensin 1-10

peptide hormone in human, mouse, rat

Chemical data

Formula
C62H89N17O14
Molecular weight
1296.5 g/mol
IUPAC name
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)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
SMILES
CC[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=C(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
InChIKey
ORWYRWWVDCYOMK-HBZPZAIKSA-N
XLogP
-1.1
Polar surface area
496 Ų
H-bond donors
16
H-bond acceptors
18
Formal charge
0

via PubChem

Wikidata facts

Mass
1295.677490528
Show 5 more facts
found in taxon
house mouse
chemical formula
C₆₂H₈₉N₁₇O₁₄
canonical SMILES
CCC(C)C(C(=O)NC(CC1=CN=CN1)C(=O)N2CCCC2C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CC4=CN=CN4)C(=O)C(C(CC(C)C)C(=O)C)N)NC(=O)C(C5=CC=C(C=C5)O)NCC(C(C)C)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(=O)O)N
isomeric SMILES
CC[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=C(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
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