5β-Pregn-7-ene-3α-ol-20-one

• Formula: C₂₁H₃₂O₂
• Molecular weight: 316.4776
• IUPAC Standard InChI: InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h5,14-15,17-19,23H,4,6-12H2,1-3H3/t14-,15-,17?,18?,19?,20?,21?/m0/s1 Copy

  
• IUPAC Standard InChIKey: DAQICXZASLZNAM-CZTKJMCCSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
• Stereoisomers:
  • 5α-Pregn-7-ene-3α-ol-20-one
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Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Van Den Dool and Kratz RI, non-polar column, custom temperature program

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Marcos, Guo, et al., 2004
Marcos, J.; Guo, L.-W.; Wilson, W.K.; Porter, F.D.; Shackleton, C., The implications of 7-dehydrosterol-7-reductase deficiency (Smith-Lemli-Opitz syndrome) to neurosteroid production, Steroids, 2004, 69, 1, 51-60, https://doi.org/10.1016/j.steroids.2003.09.013 . [all data]

Notes

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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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