indium In 111 pentetreotide
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indium In 111 pentetreotide
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CAS No:
138661-02-6
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Formula:
C63H87N13O19S2
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Chemical Name:
indium In 111 pentetreotide
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Synonyms:
111 In -pentetreotide;111-indium-pentetreotide;In-111 pentetreotide;indium In 111 pentetreotide;indium ln-111 pentetreotide;indium-pentetreotide;OctreoScan;OctreoScan 111;pentetreotide;Pentetreotide;DTPA-SMS;UNII-G083B71P98;G083B71P98;N-(2-((2-(Bis(carboxymethyl)amino)ethyl)(carboxymethyl)amino)ethyl)-N-(carboxymethyl)glycyl-D-phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-((1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl)-L-cysteinamide cyclic (3-8)-disulfide;138661-02-6;DTPA-octreotide;Pentetreotide [INN:BAN];SDZ 215-811s;SCHEMBL180440;DB12602;Q27278446;L-Cysteinamide, N-(2-((2-(bis(carboxymethyl)amino)ethyl)(carboxymethyl)amino)ethyl)-N-(carboxymethyl)glycyl-D-phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-(2-hydroxy-1-(hydroxymethyl)propyl)-, cyclic (3-8)-disulfide, (R-,(R*,R*))-
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CAS No:
Computed Properties
Molecular Weight:1394.6
XLogP3:-9.4
Hydrogen Bond Donor Count:17
Hydrogen Bond Acceptor Count:25
Rotatable Bond Count:34
Exact Mass:1393.56825994
Monoisotopic Mass:1393.56825994
Topological Polar Surface Area:545
Heavy Atom Count:97
Complexity:2590
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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