CAS RN 1177316-02-7

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3-epi-Ochratoxin A-d5, TRC

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Tekniske data

Kemisk navn eller materiale	3-epi-Ochratoxin A-d5
Anbefalet opbevaring	+4°C
Molekylvægt (g/mol)	408.84
InChI formel	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-/m0/s1/i2D,3D,4D,5D,6D
CAS	1177316-02-7
Formel vægt	408.1136 g/mol
Synonym	3S,14S-Ochratoxin A-d5,N-[[(3S)-5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-L-phenylalanine-d5;
Procent renhed	>95% (HPLC)
SMIL	[2H]c1c([2H])c([2H])c(C[C@H](NC(=O)c2cc(Cl)c3C[C@H](C)OC(=O)c3c2O)C(=O)O)c([2H])c1[2H]
IUPAC navn	(2S)-2-[[(3S)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid
Molekylær formel	C20H13D5ClNO6