1,2-Dehydro Aldosterone 21-Acetate
Product Code
TRC-D229108
Product Format
Neat
Molecular Formula
C23 H28 O6
Molecular Weight
400.465
Product Information
Chemical Data
Analyte Name
1,2-Dehydro Aldosterone 21-Acetate
Molecular Formula
C23 H28 O6
Molecular Weight
400.465
Accurate Mass
400.189
SMILES
CC(=O)OCC(=O)[C@@H]1CC[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@H]3[C@H]5C[C@@]12C(O)O5
InChI
InChI=1S/C23H28O6/c1-12(24)28-11-18(26)17-6-5-16-15-4-3-13-9-14(25)7-8-22(13,2)20(15)19-10-23(16,17)21(27)29-19/h7-9,15-17,19-21,27H,3-6,10-11H2,1-2H3/t15-,16-,17+,19-,20+,21?,22+,23+/m1/s1
IUPAC
[2-[(1S,2R,5R,6R,14R,15R,16R)-18-hydroxy-14-methyl-11-oxo-17-oxapentacyclo[14.2.1.01,5.06,15.09,14]nonadeca-9,12-dien-2-yl]-2-oxoethyl] acetate
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat