Pregnan-2,3,16-triol-20-one, MeTMS

• Formula: C₃₀H₅₈O₄Si₃
• Molecular weight: 567.0356
• IUPAC Standard InChI: InChI=1S/C30H58O4Si3/c1-20(31)28-26(33-36(7,8)9)18-24-22-14-13-21-17-25(32-35(4,5)6)27(34-37(10,11)12)19-30(21,3)23(22)15-16-29(24,28)2/h21-28H,13-19H2,1-12H3/t21?,22?,23?,24?,25?,26?,27?,28-,29-,30-/m1/s1 Copy

  
• IUPAC Standard InChIKey: YMSYNWMKAYHQKR-AACDYVSXSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
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• Information on this page:
  • Gas Chromatography
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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

Normal alkane 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.

Meng, Reyes, et al., 1997
Meng, L.-J.; Reyes, H.; Palma, J.; Hernandez, I.; Ribalta, J.; Sjövall, J., Profiles of bile acids and progesterone metabolites in the urine and serum of women with intrahepatic cholestasis of pregnancy, J. Hepatol., 1997, 27, 2, 346-357, https://doi.org/10.1016/S0168-8278(97)80181-X . [all data]

Notes

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