Analyte Name

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

CAS Number

1285592-12-2

Molecular Formula

C20 H27 N O7

Molecular Weight

393.431

Accurate Mass

393.179

SMILES

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

InChI

InChI=1S/C20H27NO7/c1-12(9-16(23)21-15(18(26)27)5-6-17(24)25)7-8-20(28)13(2)10-14(22)11-19(20,3)4/h7-10,15,28H,5-6,11H2,1-4H3,(H,21,23)(H,24,25)(H,26,27)/b8-7+,12-9-/t15-,20-/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]pentanedioic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat