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DBCO-CONH-S-S-NHS ester
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DBCO-CONH-S-S-NHS ester

Catalog NumberCCR1435934534
CAS1435934-53-4
Structure
SynonymsDBCO-CONH-S-S-COONHS ester
IUPAC Name(2,5-Dioxopyrrolidin-1-yl) 3-[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]propanoate
Molecular Weight565.66
Molecular FormulaC28H27N3O6S2
Canonical SMILESC1CC(=O)N(C1=O)OC(=O)CCSSCCNC(=O)CCC(=O)N2CC3=CC=CC=C3C#CC4=CC=CC=C42
InChIInChI=1S/C28H27N3O6S2/c32-24(29-16-18-39-38-17-15-28(36)37-31-26(34)13-14-27(31)35)11-12-25(33)30-19-22-7-2-1-5-20(22)9-10-21-6-3-4-8-23(21)30/h1-8H,11-19H2,(H,29,32)
InChI KeyRPNGUSKTYYIUDE-UHFFFAOYSA-N
AppearanceSolid
ApplicationSPAAC & SPANC Click Reaction
Storage-20 °C, Protect from light, stored under nitrogen
Complexity992
Exact Mass565.13412794
Monoisotopic Mass565.13412794
Topological Polar Surface Area164Ų

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