HIV-IN petide structure

HIV-IN petide

(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentyl]amino]-3-phenylpropanoyl]amino]-5-[[(2S)-1-[[(2S)-1-amino-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

Also Known As: HIV-IN petide|2aoe|Peptide Inhibitor CA/p2|R-V-L-r-F-E-A-Nle|H-Arg-Val-Leu-psi(CH2NH)Phe-Glu-Ala-Nle-NH2|HY-P4543|H-ARG-VAL-LEU-(R)-PHE-GLU-ALA-NLE-NH2|H-Arg-Val-Leu-r-Phe-Glu-Ala-Nle-NH2|Arg-Val-Leu-(@)-Phe-Glu-Ala-Nle-NH2|Arg-Val-Leu-(R)-Phe-Glu-Ala-Nle-NH2|N-1270|H-Arg-Val-Leu-(?)-Phe-Glu-Ala-Nle-NH2|J1.048.111B|875H356|(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentyl]amino]-3-phenylpropanoyl]amino]-5-[[(2S)-1-[[(2S)-1-amino-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid|(4S)-4-[(2S)-2-{[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-methylbutanamido]-4-methylpentyl]amino}-3-phenylpropanamido]-4-{[(1S)-1-{[(1S)-1-carbamoylpentyl]carbamoyl}ethyl]carbamoyl}butanoic acid|N-[(2r)-2-({n~5~-[amino(Iminio)methyl]-L-Ornithyl-L-Valyl}amino)-4-Methylpentyl]-L-Phenylalanyl-L-Alpha-Glutamyl-L-Alanyl-L-Norleucinamide|0Q4|L-Norleucinamide,L-arginyl-L-valyl-L-leucyl-y(CH2-NH)-L-phenylalanyl-L-a-glutamyl-L-alanyl- (9CI)

CAS: 107475-09-2
Molecular Formula C40H69N11O8
Molecular Weight 831.5331 g/mol
LogP -0.7455
Topological Polar Surface Area 328.34 Ų
Hydrogen Bond Donors 11
Hydrogen Bond Acceptors 10
Rotatable Bonds 29
Exact Mass 831.5331
Monoisotopic Mass 831.5331
Heavy Atoms 59
Complexity 1538.7599

Chemical Identifiers

CAS Number 107475-09-2
SMILES CCCC[C@@H](C(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCN=C(N)N)N

Product Overview

HIV-IN petide (CAS 107475-09-2), with molecular formula C40H69N11O8 and molecular weight 831.5331 g/mol. IUPAC: (4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentyl]amino]-3-phenylpropanoyl]amino]-5-[[(2S)-1-[[(2S)-1-amino-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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