Gly-Gly-Gly-PEG4-DBCO

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Gly-Gly-Gly-PEG4-DBCO

Gly-Gly-Gly-PEG4-DBCO | 2353409-80-8

Catalog Number R01-0342
Category Cycloalkyne Dyes (DBCO)
Molecular Formula C35H46N6O9
Molecular Weight 694.77
Catalog Number Size Price Quantity
R01-0342 -- $--

Chemical Information

Synonyms N-(14-{2-[2-(2-aminoacetamido)acetamido]acetamido}-3,6,9,12-tetraoxatetradecan-1-yl)-4-{2-azatricyclo[10.4.0.0,hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl}-4-oxobutanamide
Purity ≥95%
Shelf Life 0-4°C for short term (days to weeks), or -20°C for long term (months).
Canonical SMILES C1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCC(=O)NCCOCCOCCOCCOCCN(CC(=O)N)C(=O)CNC(=O)CN
InChI InChI=1S/C35H46N6O9/c36-23-33(44)39-24-35(46)40(26-31(37)42)14-16-48-18-20-50-22-21-49-19-17-47-15-13-38-32(43)11-12-34(45)41-25-29-7-2-1-5-27(29)9-10-28-6-3-4-8-30(28)41/h1-8H,11-26,36H2,(H2,37,42)(H,38,43)(H,39,44)
InChI Key JDXORKSIRPPONC-UHFFFAOYSA-N
Solubility 10 mm in DMSO
Appearance Solid
  • Product Specification
Storage -20°C

Computed Properties

XLogP3 -1.4
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 23
Exact Mass 694.33262707 g/mol
Monoisotopic Mass 694.33262707 g/mol
Topological Polar Surface Area 200Ų
Heavy Atom Count 50
Formal Charge 0
Complexity 1140
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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