(S)-cis,trans-Abscisic Acid O-Trityl-D-Glucosyl Ester

Analyte Name

(S)-cis,trans-Abscisic Acid O-Trityl-D-Glucosyl Ester

Molecular Formula

C40 H44 O9

Molecular Weight

668.772

Accurate Mass

668.299

SMILES

C\C(=C\C(=O)O[C@@H]1O[C@H](COC(c2ccccc2)(c3ccccc3)c4ccccc4)[C@@H](O)[C@H](O)[C@H]1O)\C=C\[C@@]5(O)C(=CC(=O)CC5(C)C)C

InChI

InChI=1S/C40H44O9/c1-26(20-21-39(46)27(2)23-31(41)24-38(39,3)4)22-33(42)49-37-36(45)35(44)34(43)32(48-37)25-47-40(28-14-8-5-9-15-28,29-16-10-6-11-17-29)30-18-12-7-13-19-30/h5-23,32,34-37,43-46H,24-25H2,1-4H3/b21-20+,26-22-/t32-,34-,35+,36-,37+,39-/m1/s1

IUPAC

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(trityloxymethyl)oxan-2-yl] (2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat