Analyte Name

3Beta-17-Imino-androst-5-en-3-ol Acetate Dimer

CAS Number

1613026-24-6

Molecular Formula

C42H60N2O4

Molecular Weight

656.94

Measured Value

1 mg/mL

Accurate Mass

656.4553

SMILES

CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=NN=C5CC[C@H]6[C@@H]7CC=C8C[C@H](CC[C@]8(C)[C@H]7CC[C@]56C)OC(=O)C)[C@@H]3CC=C2C1

InChI

InChI=1S/C42H60N2O4/c1-25(45)47-29-15-19-39(3)27(23-29)7-9-31-33-11-13-37(41(33,5)21-17-35(31)39)43-44-38-14-12-34-32-10-8-28-24-30(48-26(2)46)16-20-40(28,4)36(32)18-22-42(34,38)6/h7-8,29-36H,9-24H2,1-6H3/t29-,30-,31-,32-,33-,34-,35-,36-,39-,40-,41-,42-/m0/s1

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Acetonitrile