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Lipoamido-PEG4-acid

CAT: 0013-GTR19226469-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19226469-01Size:100 mg
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Description
Lipoamido-PEG4-acid is a heterobifunctional linker used to construct PROTAC molecules for targeted protein degradation. It connects a target-binding ligand to an E3 ligase ligand, enabling the study of protein function in both cellular and in vivo models via the ubiquitin-proteasome system.
CAS Number
1314378-10-3
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C (O) CCOCCOCCOCCOCCNC (=O) CCCCC1SSCC1
Molecular Formula
C19H35NO7S2
Molecular Weight
453.61
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Lipoamido-PEG4-acid
CAS Number1314378-10-3
PubChem CID75535062
IUPAC Name3-[2-[2-[2-[2-[5-(dithiolan-3-yl)pentanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular FormulaC19H35NO7S2
Molecular Weight453.6
XLogP0.3
Topological Polar Surface Area154
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count20
Heavy Atom Count29
Formal Charge0
Complexity429
SMILES
C1CSSC1CCCCC(=O)NCCOCCOCCOCCOCCC(=O)O
InChI
InChI=1S/C19H35NO7S2/c21-18(4-2-1-3-17-6-16-28-29-17)20-7-9-25-11-13-27-15-14-26-12-10-24-8-5-19(22)23/h17H,1-16H2,(H,20,21)(H,22,23)
InChIKey
QJFPDZROPSGMGV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lipoamido-PEG4-acid
CAS: 1314378-10-3
CID: 75535062
Formula: C19H35NO7S2
MW: 453.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight453.6
XLogP30.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count20
Exact Mass453.18549480
Monoisotopic Mass453.18549480
Topological Polar Surface Area154 Ų
Heavy Atom Count29
Formal Charge0
Complexity429
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
JDC17269Lipoamido-PEG4-acid
T15765-01Lipoamido-PEG4-azide
T18074-01Lipoamido-PEG24-acid
T18075-01Lipoamido-PEG8-acid
BIPG1467-01Lipoamido-PEG12-acid
OR1077767Lipoamido-PEg12-carboxylic Acid
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DPG-6105-01Lipoamido-dPEG®8-Acid
HY-140589Acid-PEG4-S-PEG4-acid

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