Nombre del analito

Isopenillic Acid

Número CAS

90962-63-3

Fórmula molecular

C16 H18 N2 O4 S

Peso molecular

334.39

Masa exacta

334.099

SMILES

CC(C)(S)[C@H](C(=O)O)n1cc(nc1Cc2ccccc2)C(=O)O

InChI

InChI=1S/C16H18N2O4S/c1-16(2,23)13(15(21)22)18-9-11(14(19)20)17-12(18)8-10-6-4-3-5-7-10/h3-7,9,13,23H,8H2,1-2H3,(H,19,20)(H,21,22)/t13-/m0/s1

IUPAC

2-benzyl-1-[(1S)-1-carboxy-2-methyl-2-sulfanylpropyl]imidazole-4-carboxylic acid

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat