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Acetyl-PHF6QV amide

CAT: 0804-HY-P4826Size: 1 EachDry Ice: NoHazardous: No
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Description
Acetyl-PHF6QV amide is a polypeptide that can be found by peptide screening. Peptide screening is a research tool that pools active peptides primarily by immunoassay. Peptide screening can be used for protein interaction, functional analysis, epitope screening, especially in the field of agent research and development[1].
CAS Number
2022956-52-9
UNSPSC
12352209
Target
Others
Type
Peptides
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/acetyl-phf6qv-amide.html
Solubility
10 mM in DMSO
Smiles
OC(C=C1)=CC=C1C[C@@H](C(N[C@H](C(N)=O)CCCCN)=O)NC([C@H](C(C)C)NC([C@H]([C@@H](C)CC)NC([C@H](C(C)C)NC([C@H](C(C)C)NC(C)=O)=O)=O)=O)=O
Molecular Formula
C38H64N8O8
Molecular Weight
760.96
References & Citations
[1]Birnbaum S, et al. Peptide screening. Current Opinion in Biotechnology, 1992, 3 (1) : 49-54.
Shipping Conditions
Room temperature
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

Acetyl-PHF6QV amide Trifluoroacetate
CAS Number2022956-52-9
PubChem CID145707948
IUPAC Name(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-6-aminohexanamide;2,2,2-trifluoroacetic acid
Molecular FormulaC40H65F3N8O10
Molecular Weight875.0
Topological Polar Surface Area301
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count14
Rotatable Bond Count23
Heavy Atom Count61
Formal Charge0
Complexity1340
SMILES
CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)C.C(=O)(C(F)(F)F)O
InChI
InChI=1S/C38H64N8O8.C2HF3O2/c1-10-23(8)32(46-37(53)31(22(6)7)44-36(52)29(20(2)3)41-24(9)47)38(54)45-30(21(4)5)35(51)43-28(19-25-14-16-26(48)17-15-25)34(50)42-27(33(40)49)13-11-12-18-39;3-2(4,5)1(6)7/h14-17,20-23,27-32,48H,10-13,18-19,39H2,1-9H3,(H2,40,49)(H,41,47)(H,42,50)(H,43,51)(H,44,52)(H,45,54)(H,46,53);(H,6,7)/t23-,27-,28-,29-,30-,31-,32-;/m0./s1
InChIKey
JVCGZJDGRWECLW-IJPVZMTKSA-N
Chemical Structure
2D Structure
2D structure of Acetyl-PHF6QV amide Trifluoroacetate
CAS: 2022956-52-9
CID: 145707948
Formula: C40H65F3N8O10
MW: 875.0
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight875.0
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count14
Rotatable Bond Count23
Exact Mass874.47757479
Monoisotopic Mass874.47757479
Topological Polar Surface Area301 Ų
Heavy Atom Count61
Formal Charge0
Complexity1340
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes