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1334172-63-2 | Fmoc-N-amido-(PEG4-biotin)-acid
CAS No: 1334172-63-2 Catalog No: AG019E16 MDL No:
Product Description
Catalog Number:
AG019E16
Chemical Name:
Fmoc-N-amido-(PEG4-biotin)-acid
CAS Number:
1334172-63-2
IUPAC Name:
3-[3-[2-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-3-[ethoxycarbonyl(9H-fluoren-9-ylmethoxycarbonyl)amino]propanoic acid
InChI:
InChI=1S/C42H57N5O13S/c1-2-59-41(53)47(42(54)60-26-32-30-11-5-3-9-28(30)29-10-4-6-12-31(29)32)35(25-38(50)51)45-37(49)15-17-55-19-21-57-23-24-58-22-20-56-18-16-43-36(48)14-8-7-13-34-39-33(27-61-34)44-40(52)46-39/h3-6,9-12,32-35,39H,2,7-8,13-27H2,1H3,(H,43,48)(H,45,49)(H,50,51)(H2,44,46,52)/t33-,34-,35?,39-/m0/s1
InChI Key:
HWHBADQANZTZAY-HYVFJNSESA-N
Properties
Complexity:
1410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
871.367g/mol
Formal Charge:
0
Heavy Atom Count:
61
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
872g/mol
Monoisotopic Mass:
871.367g/mol
Rotatable Bond Count:
29
Topological Polar Surface Area:
255A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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