Analyte Name

(1R,3R)-5-[(Z)-2-[(1R,3aR,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-4-ene-1,3-diol

CAS Number

66760-29-0

Molecular Formula

C27 H44 O3

Molecular Weight

416.637

Accurate Mass

416.329

SMILES

C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2C(=CCC[C@]12C)\C=C/C3=C(C)[C@H](O)C[C@H](O)C3

InChI

InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(28)17-25(29)19(21)2/h9-11,18,22-25,28-30H,6-8,12-17H2,1-5H3/b11-10-/t18-,22-,23-,24+,25-,27-/m1/s1

IUPAC

(1R,3R)-5-[(Z)-2-[(1R,3aR,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-4-ene-1,3-diol

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat