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TCO-PEG4-biotin

CAT: 0931-T17016-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T17016-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2183440-30-2
Target
Others, PROTAC Linker
Related Pathways
Others, PROTAC
Bioactivity
TCO-PEG4-biotin is a PROTAC linker belonging to the PEG class.TCO-PEG4-biotin can be used to synthesise a range of PROTAC molecules.
Smiles
C(CCCC(NCCOCCOCCOCCOCCNC(OC1CCCC=CCC1)=O)=O)[C@H]2[C@@]3([C@](CS2)(NC(=O)N3)[H])[H]
Molecular Formula
C29H50N4O8S
Molecular Weight
614.79
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

CID 146026027
CAS Number2183440-30-2
PubChem CID146026027
IUPAC Name[(4Z)-cyclooct-4-en-1-yl] N-[2-[2-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Molecular FormulaC29H50N4O8S
Molecular Weight614.8
XLogP1.5
Topological Polar Surface Area171
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count22
Heavy Atom Count42
Formal Charge0
Complexity821
SMILES
C1C/C=C\CCC(C1)OC(=O)NCCOCCOCCOCCOCCNC(=O)CCCC[C@H]2[C@@H]3[C@H](CS2)NC(=O)N3
InChI
InChI=1S/C29H50N4O8S/c34-26(11-7-6-10-25-27-24(22-42-25)32-28(35)33-27)30-12-14-37-16-18-39-20-21-40-19-17-38-15-13-31-29(36)41-23-8-4-2-1-3-5-9-23/h1-2,23-25,27H,3-22H2,(H,30,34)(H,31,36)(H2,32,33,35)/b2-1-/t23?,24-,25-,27-/m0/s1
InChIKey
OADGBCNDNVFPDA-MSCWDKBPSA-N
Chemical Structure
2D Structure
2D structure of CID 146026027
CAS: 2183440-30-2
CID: 146026027
Formula: C29H50N4O8S
MW: 614.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight614.8
XLogP31.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count22
Exact Mass614.33493574
Monoisotopic Mass614.33493574
Topological Polar Surface Area171 Ų
Heavy Atom Count42
Formal Charge0
Complexity821
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
GTR19226136-01TCO-PEG4-biotin
HY-141188TCO-PEG4-TCO
573035TCO-PEG4-acid
HY-W800817TCO-PEG4-maleimide
HY-141179-01TCO-PEG4-amine
BXC86388-01TCO-PEG4-DBCO
GTR19226630-01BDP FL-PEG4-TCO
HY-W800839TCO-PEG4-TFP ester
HY-133432-01DBCO-PEG4-SS-TCO

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