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CEF4

CAT: 0804-HY-P0304Size: 1 EachDry Ice: NoHazardous: No
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Description
CEF4 is a peptide that corresponds to aa 342-351 of the influenza A virus nucleocapsid protein.
CAS Number
199727-68-9
UNSPSC
12352209
Target
Influenza Virus
Type
Peptides
Related Pathways
Anti-infection
Applications
COVID-19-anti-virus
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/CEF4.html
Solubility
H2O
Smiles
O=C(N[C@@H](C(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CO)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](CCCCN)C(NCC(N[C@@H]([C@H](O)C)C(N[C@@H](CCCCN)C(O)=O)=O)=O)=O)=O)=O)=O)=O)=O)[C@H](CCCNC(N)=N)N
Molecular Formula
C53H93N15O13
Molecular Weight
1148.40
Shipping Conditions
Room temperature
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

CID 146157903
CAS Number199727-68-9
PubChem CID146157903
IUPAC Name6-amino-2-[[2-[[2-[[6-amino-2-[[2-[[2-[[2-[[2-[[2-[[2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]hexanoic acid
Molecular FormulaC53H93N15O13
Molecular Weight1148.4
XLogP-3.8
Topological Polar Surface Area482
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count17
Rotatable Bond Count40
Heavy Atom Count81
Formal Charge0
Complexity2040
SMILES
CCC(C)C(C(=O)NC(CCCCN)C(=O)NCC(=O)NC(C(C)O)C(=O)NC(CCCCN)C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CO)NC(=O)C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(CCCN=C(N)N)N
InChI
InChI=1S/C53H93N15O13/c1-8-31(6)42(50(78)61-35(20-12-14-22-54)45(73)60-27-40(71)66-43(32(7)70)51(79)62-36(52(80)81)21-13-15-23-55)68-47(75)38(26-33-17-10-9-11-18-33)63-48(76)39(28-69)65-46(74)37(25-29(2)3)64-49(77)41(30(4)5)67-44(72)34(56)19-16-24-59-53(57)58/h9-11,17-18,29-32,34-39,41-43,69-70H,8,12-16,19-28,54-56H2,1-7H3,(H,60,73)(H,61,78)(H,62,79)(H,63,76)(H,64,77)(H,65,74)(H,66,71)(H,67,72)(H,68,75)(H,80,81)(H4,57,58,59)
InChIKey
KBYAVSUZGDPFOZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CID 146157903
CAS: 199727-68-9
CID: 146157903
Formula: C53H93N15O13
MW: 1148.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1148.4
XLogP3-3.8
Hydrogen Bond Donor Count17
Hydrogen Bond Acceptor Count17
Rotatable Bond Count40
Exact Mass1147.70772808
Monoisotopic Mass1147.70772808
Topological Polar Surface Area482 Ų
Heavy Atom Count81
Formal Charge0
Complexity2040
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count11
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
FC73323-01CEF4
GTR18896351-01CEF4 peptide
TP1814L-01CEF4 acetate
SP-55361-1CEF4 [H-Arg-Val-Leu-Ser-Phe-Ile-Lys-Gly-Thr-Lys-OH; MW: 1148.42]

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