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DBCO-PEG3-TCO
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DBCO-PEG3-TCO

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Catalog NumberCCR203
IUPAC Name[(1S,4E)-Cyclooct-4-en-1-yl] N-[2-[2-[2-[2-[[4-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-4-oxobutanoyl]amino]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Molecular Weight631.8
Molecular FormulaC36H45N3O7
Canonical SMILESC1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCNC(=O)CCC(=O)N2CC3=CC=CC=C3C#CC4=CC=CC=C42
InChIInChI=1S/C36H45N3O7/c40-34(18-19-35(41)39-28-31-12-7-6-10-29(31)16-17-30-11-8-9-15-33(30)39)37-20-22-43-24-26-45-27-25-44-23-21-38-36(42)46-32-13-4-2-1-3-5-14-32/h1-2,6-12,15,32H,3-5,13-14,18-28H2,(H,37,40)(H,38,42)/b2-1+/t32-/m1/s1
InChI KeyOYEIJQBQBCHZLD-XIASJIJZSA-N
ApplicationIEDDA Click Reaction
Complexity1040
Exact Mass631.32575078
Isomeric SMILESC1C/C=C/CC[C@H](C1)OC(=O)NCCOCCOCCOCCNC(=O)CCC(=O)N2CC3=CC=CC=C3C#CC4=CC=CC=C42
Monoisotopic Mass631.32575078
Topological Polar Surface Area115Ų

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