Analyte Name

(+)-cis,trans-Abscisic Acid-L-aspartic Acid

CAS Number

1285592-10-0

Molecular Formula

C19 H25 N O7

Molecular Weight

379.404

Accurate Mass

379.163

SMILES

C\C(=C\C(=O)N[C@@H](CC(=O)O)C(=O)O)\C=C\[C@]1(O)C(=CC(=O)CC1(C)C)C

InChI

InChI=1S/C19H25NO7/c1-11(7-15(22)20-14(17(25)26)9-16(23)24)5-6-19(27)12(2)8-13(21)10-18(19,3)4/h5-8,14,27H,9-10H2,1-4H3,(H,20,22)(H,23,24)(H,25,26)/b6-5+,11-7-/t14-,19-/m0/s1

IUPAC

(2S)-2-[[(2Z,4E)-5-[(1R)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoyl]amino]butanedioic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat