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N-(DBCO-PEG4)-N-biotin-PEG4-acid
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N-(DBCO-PEG4)-N-biotin-PEG4-acid

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Catalog NumberCCR247
IUPAC Name3-[2-[2-[2-[2-[5-[(3aS,4S,6aR)-2-Oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoyl-[2-[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]ethoxy]ethyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular Weight998.2
Molecular FormulaC50H71N5O14S
Canonical SMILESC1C2C(C(S1)CCCCC(=O)N(CCOCCOCCOCCOCCC(=O)O)CCOCCOCCOCCOCCNC(=O)CCC(=O)N3CC4=CC=CC=C4C#CC5=CC=CC=C53)NC(=O)N2
InChIInChI=1S/C50H71N5O14S/c56-45(15-16-47(58)55-37-41-9-2-1-7-39(41)13-14-40-8-3-4-10-43(40)55)51-18-22-63-26-30-67-34-36-69-32-28-65-24-20-54(19-23-64-27-31-68-35-33-66-29-25-62-21-17-48(59)60)46(57)12-6-5-11-44-49-42(38-70-44)52-50(61)53-49/h1-4,7-10,42,44,49H,5-6,11-12,15-38H2,(H,51,56)(H,59,60)(H2,52,53,61)/t42-,44-,49-/m0/s1
InChI KeyUTSGOLXAYDVUIL-QXMSZIEOSA-N
Purity98%
ApplicationSPAAC & SPANC Click Reaction
Storage-20 °C
Complexity1620
Exact Mass997.47182313
Isomeric SMILESC1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)N(CCOCCOCCOCCOCCC(=O)O)CCOCCOCCOCCOCCNC(=O)CCC(=O)N3CC4=CC=CC=C4C#CC5=CC=CC=C53)NC(=O)N2
Monoisotopic Mass997.47182313
Topological Polar Surface Area247Ų

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