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3-BETA-(PARA-METHOXYBENZOYLOXY)-PREGNA-4,16-DIENE-6,20-DIONE
SpectraBase Compound ID 6Z5GsoSwUCK
InChI InChI=1S/C29H34O5/c1-17(30)22-9-10-23-21-16-26(31)25-15-20(34-27(32)18-5-7-19(33-4)8-6-18)11-13-29(25,3)24(21)12-14-28(22,23)2/h5-9,15,20-21,23-24H,10-14,16H2,1-4H3/t20-,21-,23-,24-,28+,29+/m0/s1
InChIKey GGAAWHCOUNQSGI-OYLQBTODSA-N
Mol Weight 462.6 g/mol
Molecular Formula C29H34O5
Exact Mass 462.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GUlRJCsqyVc
Name 3-BETA-(PARA-METHOXYBENZOYLOXY)-PREGNA-4,16-DIENE-6,20-DIONE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H34O5
InChI InChI=1S/C29H34O5/c1-17(30)22-9-10-23-21-16-26(31)25-15-20(34-27(32)18-5-7-19(33-4)8-6-18)11-13-29(25,3)24(21)12-14-28(22,23)2/h5-9,15,20-21,23-24H,10-14,16H2,1-4H3/t20-,21-,23-,24-,28+,29+/m0/s1
InChIKey GGAAWHCOUNQSGI-OYLQBTODSA-N
Literature Reference Author J.LI,H.LI,Y.LI
Literature Reference Citation CHEM.CENTR.J.,4,18,1(2010)
Molecular Weight 462.586 g/mol
Solvent CDCl3
Source File Reference UWIR11796