21-Acetoxy-11-oxo-16Alpha,17Alpha-propylmethylenedioxpregna-1,4-diene-3,20-dione

Analyte Name

21-Acetoxy-11-oxo-16alpha,17alpha-propylmethylenedioxpregna-1,4-diene-3,20-dione

CAS Number

1831164-04-5

Molecular Formula

C27H34O7

Molecular Weight

470.56

Accurate Mass

470.23

SMILES

O=C1C=C[C@@]2(C)C(CC[C@]([C@@](C[C@@H](OC(CCC)O3)[C@]43C(COC(C)=O)=O)([H])[C@]4(C)C5)([H])[C@]2([H])C5=O)=C1

InChI

InChI=1S/C27H34O7/c1-5-6-23-33-22-12-19-18-8-7-16-11-17(29)9-10-25(16,3)24(18)20(30)13-26(19,4)27(22,34-23)21(31)14-32-15(2)28/h9-11,18-19,22-24H,5-8,12-14H2,1-4H3/t18-,19-,22+,23?,24+,25-,26-,27+/m0/s1

IUPAC

2-((6aR,6bS,8aS,8bS,11aR,12aS,12bS)-6a,8a-dimethyl-4,7-dioxo-10-propyl-1,2,4,6a,6b,7,8,8a,11a,12,12a,12b-dodecahydro-8bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-8b-yl)-2-oxoethyl acetate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat