1,2-Dihydro Exemestane[1,2-二氢依西美坦]

19457-55-7

CAS Name

6-Methyleneandrost-4-ene-3,17-dione

Molecular Formula

C₂₀H₂₆O₂

Molecular Mass

298.42

Compound Properties

• Melting Point (1)

  163-165 °C

Source(s)

• (1) NevilleKirk, David; US3112305, 1963, CAplus

Other Names and Identifiers

InChI

InChI=1S/C20H26O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h11,14-16H,1,4-10H2,2-3H3/t14-,15-,16-,19+,20-/m0/s1

InChIKey

InChIKey=KQRGETZTRARSMA-DAELLWKTSA-N

SMILES

C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)C(=O)CC4)[H])(CC(=C)C1=CC(=O)CC2)[H])[H]

Canonical SMILES

O=C1C=C2C(=C)CC3C4CCC(=O)C4(C)CCC3C2(C)CC1

Other Names for this Substance