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Tat-beclin 1 5mg

CAT: 0628-A22737-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A22737-5Size:5 mg
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CAS Number
1423821-88-8

Chemical Information

Tat-beclin 1
CAS Number1423821-88-8
PubChem CID164185590
IUPAC Name4-[[2-[[3-carboxy-2-[[2-[[2-[2-[1-[[4-carboxy-1-[(5-formamido-3,4-dioxo-1-phenylpentan-2-yl)amino]-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]hydrazinyl]-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]acetyl]amino]-5-[[1-[[2-[(1-carboxy-2-hydroxypropyl)amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid
Molecular FormulaC66H83N15O21
Molecular Weight1422.5
XLogP-5.5
Topological Polar Surface Area563
Hydrogen Bond Donor Count19
Hydrogen Bond Acceptor Count24
Rotatable Bond Count45
Heavy Atom Count102
Formal Charge0
Complexity2920
SMILES
CCC(C)C(C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)C(=O)CNC=O)NNC(CC2=CNC3=CC=CC=C32)C(=O)NC(CC4=CN=CN4)C(=O)NC(CC(=O)O)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(CC5=CC=CC=C5)C(=O)NCC(=O)NC(C(C)O)C(=O)O
InChI
InChI=1S/C66H83N15O21/c1-4-35(2)56(65(100)74-44(20-22-54(89)90)62(97)75-45(23-37-13-7-5-8-14-37)58(93)50(84)30-68-34-82)81-80-49(25-39-28-69-42-18-12-11-17-41(39)42)64(99)77-47(26-40-29-67-33-72-40)63(98)78-48(27-55(91)92)60(95)70-31-51(85)73-43(19-21-53(87)88)61(96)76-46(24-38-15-9-6-10-16-38)59(94)71-32-52(86)79-57(36(3)83)66(101)102/h5-18,28-29,33-36,43-49,56-57,69,80-81,83H,4,19-27,30-32H2,1-3H3,(H,67,72)(H,68,82)(H,70,95)(H,71,94)(H,73,85)(H,74,100)(H,75,97)(H,76,96)(H,77,99)(H,78,98)(H,79,86)(H,87,88)(H,89,90)(H,91,92)(H,101,102)
InChIKey
QQPORJWPQLZFOI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tat-beclin 1
CAS: 1423821-88-8
CID: 164185590
Formula: C66H83N15O21
MW: 1422.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1422.5
XLogP3-5.5
Hydrogen Bond Donor Count19
Hydrogen Bond Acceptor Count24
Rotatable Bond Count45
Exact Mass1421.58879472
Monoisotopic Mass1421.58879472
Topological Polar Surface Area563 Ų
Heavy Atom Count102
Formal Charge0
Complexity2920
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
C13526-5mgTat-beclin 1 (Tat-BECN1)
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CRB1000911-01TAT-Beclin Scrambled - (TAT Conjugated Peptides)
CRB1000910-01TAT-Beclin 1 - (TAT Conjugated Peptides)
HY-P2260B-01Tat-beclin 1 scrambled
T76058-01Tat-beclin 1 TFA
GTR18919139-01Tat-beclin 1 acetate
HY-P2260ATat-beclin 1 (TFA)

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