Pyronaridine-13C2 , d4 Tetraphosphate Salt
Product Code
TRC-P997647
Product Format
Neat
Molecular Formula
C27¹³C2H28D4ClN5O2 • 4H 3PO4
Molecular Weight
916.06
Product Categories
TRC, Stable isotopes, Stable Isotope Labelled Analytical Standards
Product Type
Stable Isotope LabelledAlternate CAS Number
Unlabelled CAS Number
HPLC Purity
>95%
Documentation
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Product Information
Chemical Data
Analyte Name
Pyronaridine-13C2 , d4 Tetraphosphate Salt
Molecular Formula
C27¹³C2H28D4ClN5O2 • 4H 3PO4
Molecular Weight
916.06
Accurate Mass
915.18
SMILES
ClC1=CC2=NC3=CC=C(OC)N=C3C(NC4=CC([13C]([2H])([2H])N5CCCC5)=C(O)C([13C]([2H])([2H])N6CCCC6)=C4)=C2C=C1.O=P(OO)=O.O=P(OO)=O.O=P(OO)=O.O=P(OO)=O.[HH].[HH].[HH].[HH]
InChI
InChI=1S/C29H32ClN5O2.4HO4P.4H2/c1-37-26-9-8-24-28(33-26)27(23-7-6-21(30)16-25(23)32-24)31-22-14-19(17-34-10-2-3-11-34)29(36)20(15-22)18-35-12-4-5-13-35;4*1-4-5(2)3;;;;/h6-9,14-16,36H,2-5,10-13,17-18H2,1H3,(H,31,32);4*1H;4*1H/i17+1D2,18+1D2;;;;;;;;
IUPAC
phosphenoperoxoic acid--4-((7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-yl)amino)-2,6-bis(pyrrolidin-1-ylmethyl-13C-d2)phenol--dihydrogen (4/1/4)
Alternate CAS Number
Free base: 1261393-31-0
Unlabelled CAS Number
74847-35-1
SIL Type
Deuterium, Carbon
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
HPLC Purity
>95%
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