Ochratoxin A-13C6
Product Specifications
Hazard Statement
No Data Available; UN number: UN3462; Packing Group: II
Smiles
C[C@@H]1CC2=C(C(O1)=O)C(O)=C(C(N[C@H](C(O)=O)C[13C]3=[13CH][13CH]=[13CH][13CH]=[13CH]3)=O)C=C2Cl
Molecular Formula
C14¹³C6H18ClNO6
Molecular Weight
409.77
InChI
InChI=1S/C20H18ClNO6/c1-10-7-12-14(21)9-13(17(23)16(12)20(27)28-10)18(24)22-15(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,15,23H,7-8H2,1H3,(H,22,24)(H,25,26)/t10-,15+/m1/s1/i2+1,3+1,4+1,5+1,6+1,11+1
Additionnal Information
IUPAC name: (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid;(1,2,3,4,5,6-13C6)hepta-1,3,5-triyne
Shipping Conditions
Room Temperature
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