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TERMINAMINE_G;3-ALPHA-(METHYLBENZOYLAMINO)-PREGNAN-20-ONE
SpectraBase Compound ID KDDmSyFlkSi
InChI InChI=1S/C29H41NO2/c1-19(31)24-12-13-25-23-11-10-21-18-22(30(4)27(32)20-8-6-5-7-9-20)14-16-28(21,2)26(23)15-17-29(24,25)3/h5-9,21-26H,10-18H2,1-4H3/t21-,22+,23-,24+,25-,26-,28-,29+/m0/s1
InChIKey IAVDKJWBPMWUDM-WCKWMXOKSA-N
Mol Weight 435.7 g/mol
Molecular Formula C29H41NO2
Exact Mass 435.31373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GzzeKznSUd7
Name TERMINAMINE_G;3-ALPHA-(METHYLBENZOYLAMINO)-PREGNAN-20-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H41NO2
InChI InChI=1S/C29H41NO2/c1-19(31)24-12-13-25-23-11-10-21-18-22(30(4)27(32)20-8-6-5-7-9-20)14-16-28(21,2)26(23)15-17-29(24,25)3/h5-9,21-26H,10-18H2,1-4H3/t21-,22+,23-,24+,25-,26-,28-,29+/m0/s1
InChIKey IAVDKJWBPMWUDM-WCKWMXOKSA-N
Literature Reference Author H.Y.ZHAI,C.ZHAO,N.ZHANG,M.N.JIN,S.A.TANG,N.QIN,D.X.KONG,H.Q. DUAN
Literature Reference Citation J.NAT.PROD.,75,1305(2012)
Literature Reference DOI 10.1021/np300207c
Molecular Weight 435.650 g/mol
Sample ID 41262
Solvent CDCl3