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DBCO-NHCO-PEG7-acid
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DBCO-NHCO-PEG7-acid

Catalog NumberCCR216
SynonymsDBCO-NH-PEG7-acid
IUPAC Name3-[2-[2-[2-[2-[2-[2-[3-[[3-(2-Azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular Weight684.8
Molecular FormulaC36H48N2O11
Canonical SMILESC1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCC(=O)O
InChIInChI=1S/C36H48N2O11/c39-34(37-14-11-35(40)38-29-32-7-2-1-5-30(32)9-10-31-6-3-4-8-33(31)38)12-15-43-17-19-45-21-23-47-25-27-49-28-26-48-24-22-46-20-18-44-16-13-36(41)42/h1-8H,11-29H2,(H,37,39)(H,41,42)
InChI KeyXYFCCMAQJJOQRL-UHFFFAOYSA-N
ApplicationSPAAC & SPANC Click Reaction
Complexity1000
Exact Mass684.32581035
Monoisotopic Mass684.32581035
Topological Polar Surface Area151Ų

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