3-Dehydroteasterone

CAS Registry Number®

124853-28-7

CAS Name

3-Dehydroteasterone

Molecular Formula

C28H46O4

Molecular Mass

446.66

Cite this Page

3-Dehydroteasterone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=124853-28-7 (retrieved 2024-12-23) (CAS RN: 124853-28-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    201-202 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C28H46O4/c1-15(2)16(3)25(31)26(32)17(4)20-7-8-21-19-14-24(30)23-13-18(29)9-11-28(23,6)22(19)10-12-27(20,21)5/h15-17,19-23,25-26,31-32H,7-14H2,1-6H3/t16-,17-,19-,20+,21-,22-,23+,25+,26+,27+,28+/m0/s1

InChIKey

InChIKey=SVBMASFUJDIDJC-XFJIFGBKSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@@](C(=O)C3)(CC(=O)CC4)[H])(CC1)[H])[H])(CC[C@@]2([C@@H]([C@H]([C@@H]([C@H](C(C)C)C)O)O)C)[H])[H]

Canonical SMILES

O=C1CCC2(C)C(C(=O)CC3C4CCC(C(C)C(O)C(O)C(C)C(C)C)C4(C)CCC32)C1

Other Names for this Substance

  • Ergostane-3,6-dione, 22,23-dihydroxy-, (5α,22R,23R,24S)-
  • (5α,22R,23R,24S)-22,23-Dihydroxyergostane-3,6-dione
  • 3-Oxoteasterone
  • 3-Dehydroteasterone

CAS INSIGHTSTM
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