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Androsterone
SpectraBase Compound ID scbtt7fxuB
InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1
InChIKey QGXBDMJGAMFCBF-HLUDHZFRSA-N
Mol Weight 290.45 g/mol
Molecular Formula C19H30O2
Exact Mass 290.22458 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ChqReQrrSRC
Name Androsterone
Acquisition Mode SIMULTANEOUS
CAS Registry Number 53-41-8
ChEBI ID 16032
Comments Saturated androsterone - Sigma-Aldrich; Solvent acetone; pH , temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium
Formula C19 H30 O2
IUPAC Name (3R,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
InChI InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1
InChIKey QGXBDMJGAMFCBF-HLUDHZFRSA-N
KEGG Compound ID C00523
KEGG Pathways PATH: ko00150 Androgen and estrogen metabolism
PubChem Compound ID 5879
SMILES CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)O
Source File Reference bmse000543