Analyte Name

(4R)-4-((3S,9R,10S,13R,14R,17R)-10,13-dimethyl-3-((tetrahydro-2H-pyran-2-yl)oxy)-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanal

Molecular Formula

C29 H46 O3

Molecular Weight

442.674

Accurate Mass

442.345

SMILES

C[C@H](CCC=O)[C@H]1CC[C@H]2C3=CCC4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC5CCCCO5

InChI

InChI=1S/C29H46O3/c1-20(7-6-17-30)24-11-12-25-23-10-9-21-19-22(32-27-8-4-5-18-31-27)13-15-28(21,2)26(23)14-16-29(24,25)3/h10,17,20-22,24-27H,4-9,11-16,18-19H2,1-3H3/t20-,21?,22+,24-,25+,26+,27?,28+,29-/m1/s1

IUPAC

(4R)-4-[(3S,9R,10S,13R,14R,17R)-10,13-dimethyl-3-(oxan-2-yloxy)-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanal

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat