1-(4-Chlorophenyl)-5-[6-[[4-[(4-chlorophenyl)amino]-6-[(1S,2R,3R,4R)-1,2,3,4,5-pentahydroxypentyl]-1,3,5-triazin-2-yl]amino]hexyl]biguanide-d8
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- structure.search.product.name 1-(4-Chlorophenyl)-5-[6-[[4-[(4-chlorophenyl)amino]-6-[(1S,2R,3R,4R)-1,2,3,4,5-pentahydroxypentyl]-1,3,5-triazin-2-yl]amino]hexyl]biguanide-d8
- Product Code: TRC-C378547
- Brand: TRC
Product Overview
Product Code
TRC-C378547
Product Format
Neat
Molecular Formula
C28 D8 H30 Cl2 N10 O5
Molecular Weight
673.621
Product Categories
TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials
Product Type
Stable Isotope LabelledDocumentation
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Product Information
Chemical Data
Analyte Name
1-(4-Chlorophenyl)-5-(6-((4-((4-chlorophenyl)amino)-6-((1S,2R,3R,4R)-1,2,3,4,5-pentahydroxypentyl)-1,3,5-triazin-2-yl)amino)hexyl)biguanide-d8
Molecular Formula
C28 D8 H30 Cl2 N10 O5
Molecular Weight
673.621
Accurate Mass
672.291
SMILES
[2H]c1c([2H])c(NC(=N)NC(=N)NCCCCCCNc2nc(Nc3c([2H])c([2H])c(Cl)c([2H])c3[2H])nc(n2)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)c([2H])c([2H])c1Cl
InChI
InChI=1S/C28H38Cl2N10O5/c29-16-5-9-18(10-6-16)35-26(32)39-25(31)33-13-3-1-2-4-14-34-27-37-24(23(45)22(44)21(43)20(42)15-41)38-28(40-27)36-19-11-7-17(30)8-12-19/h5-12,20-23,41-45H,1-4,13-15H2,(H5,31,32,33,35,39)(H2,34,36,37,38,40)/t20-,21-,22+,23-/m1/s1/i5D,6D,7D,8D,9D,10D,11D,12D
IUPAC
1-[6-[[4-(4-chloro-2,3,5,6-tetradeuterioanilino)-6-[(1S,2R,3R,4R)-1,2,3,4,5-pentahydroxypentyl]-1,3,5-triazin-2-yl]amino]hexyl]-3-[N-(4-chloro-2,3,5,6-tetradeuteriophenyl)carbamimidoyl]guanidine
SIL Type
Deuterium
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Stable Isotope Labelled
Product Format
Neat
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