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Biotin-PEG4-methyltetrazine
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Biotin-PEG4-methyltetrazine

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Catalog NumberCCR1835759813
CAS1835759-81-3
SynonymsN-(2-(2-(2-(2-(4-(6-Methyl-1,2,4,5-tetrazin-3-yl)phenoxy)ethoxy)ethoxy)ethoxy)ethyl)-5-((3aR,4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide
IUPAC Name5-[(3aR,4R,6aS)-2-Oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethyl]pentanamide
Molecular Weight589.71
Molecular FormulaC27H39N7O6S
Canonical SMILESCC1=NN=C(N=N1)C2=CC=C(C=C2)OCCOCCOCCOCCNC(=O)CCCCC3C4C(CS3)NC(=O)N4
InChIInChI=1S/C27H39N7O6S/c1-19-31-33-26(34-32-19)20-6-8-21(9-7-20)40-17-16-39-15-14-38-13-12-37-11-10-28-24(35)5-3-2-4-23-25-22(18-41-23)29-27(36)30-25/h6-9,22-23,25H,2-5,10-18H2,1H3,(H,28,35)(H2,29,30,36)/t22-,23-,25-/m1/s1
InChI KeyFTGDGKKLLGMCLG-VDKIKQQVSA-N
Purity98%+
SolubilitySoluble in DMSO, DMF
AppearanceSolid
ApplicationIEDDA Click Reaction
Storage4 °C, Sealed storage, away from moisture
Complexity770
Exact Mass589.26825316
Isomeric SMILESCC1=NN=C(N=N1)C2=CC=C(C=C2)OCCOCCOCCOCCNC(=O)CCCC[C@@H]3[C@H]4[C@@H](CS3)NC(=O)N4
Monoisotopic Mass589.26825316
Topological Polar Surface Area184Ų

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