(3aR,5R,6R,7R,7aR)-3a-(aminomethyl)-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydropyrano[3,2-d][1,3]thiazole-6,7-diol; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: (3aR,5R,6R,7R,7aR)-3a-(aminomethyl)-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydropyrano[3,2-d][1,3]thiazole-6,7-diol; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: (3aR,5R,6R,7R,7aR)-3a-(aminomethyl)-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydropyrano[3,2-d]thiazole-6,7-diol; 2,2,2-trifluoroacetic acid CAS Name: (3aR,5R,6R,7R,7aR)-3a-(aminomethyl)-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydropyrano[3,2-d]thiazole-6,7-diol; 2,2,2-trifluoroacetic acid IUPAC Name: (3aR,5R,6R,7R,7aR)-3a-(aminomethyl)-5-(hydroxymethyl)-2-methyl-5,6,7,7a-tetrahydropyrano[3,2-d][1,3]thiazole-6,7-diol; 2,2,2-trifluoroacetic acid Traditional Name: (3aR,5R,6R,7R,7aR)-3a-(aminomethyl)-2-methyl-5-methylol-5,6,7,7a-tetrahydropyrano[3,2-d]thiazole-6,7-diol; 2,2,2-trifluoroacetic acid Formula: C11H17F3N2O6S MolecularWeight: 362.32269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2C(C(C(OC2(S1)CN)CO)O)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=N[C@@H]2[C@H]([C@H]([C@H](O[C@@]2(S1)CN)CO)O)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C9H16N2O4S.C2HF3O2/c1-4-11-8-7(14)6(13)5(2-12)15-9(8,3-10)16-4;3-2(4,5)1(6)7/h5-8,12-14H,2-3,10H2,1H3;(H,6,7)/t5-,6+,7+,8-,9-;/m1./s1