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DBCO-S-S-acid
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DBCO-S-S-acid

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Catalog NumberCCR2749426251
CAS2749426-25-1
IUPAC Name3-[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]ethyldisulfanyl]propanoic acid
Molecular Weight468.59
Molecular FormulaC24H24N2O4S2
Canonical SMILESC1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCC(=O)NCCSSCCC(=O)O
InChIInChI=1S/C24H24N2O4S2/c27-22(25-14-16-32-31-15-13-24(29)30)11-12-23(28)26-17-20-7-2-1-5-18(20)9-10-19-6-3-4-8-21(19)26/h1-8H,11-17H2,(H,25,27)(H,29,30)
InChI KeyPEZSNNGHQIWOEV-UHFFFAOYSA-N
ApplicationSPAAC & SPANC Click Reaction
Complexity732
Exact Mass468.11774960
Monoisotopic Mass468.11774960
Topological Polar Surface Area137Ų

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