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HIRTINONE;19-METHYLENE-25-HYDROXY-20,24-OXIDECYCLOARTAN-3-ONE
SpectraBase Compound ID 7kxo7WrPoT0
InChI InChI=1S/C30H48O3/c1-25(2)21-8-9-22-28(6)13-11-20(19-7-10-24(33-17-19)26(3,4)32)27(28,5)15-16-30(22)18-29(21,30)14-12-23(25)31/h19-22,24,32H,7-18H2,1-6H3/t19?,20-,21-,22+,24+,27-,28+,29+,30-/m0/s1
InChIKey PGSLAQBXPNWEEY-MVFDGQNBSA-N
Mol Weight 456.7 g/mol
Molecular Formula C30H48O3
Exact Mass 456.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87mtR5kLidn
Name HIRTINONE;19-METHYLENE-25-HYDROXY-20,24-OXIDECYCLOARTAN-3-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O3
InChI InChI=1S/C30H48O3/c1-25(2)21-8-9-22-28(6)13-11-20(19-7-10-24(33-17-19)26(3,4)32)27(28,5)15-16-30(22)18-29(21,30)14-12-23(25)31/h19-22,24,32H,7-18H2,1-6H3/t19?,20-,21-,22+,24+,27-,28+,29+,30-/m0/s1
InChIKey PGSLAQBXPNWEEY-MVFDGQNBSA-N
Literature Reference Author I.J.C.VIEIRA,O.D.A.AZEVEDO,J.J.D.SOUZA,R.BRAZ-FILHO,M.D.S.GO NCALVES,M.F.D.ARAUJO
Literature Reference Citation MOLECULES,18,2589(2013)
Literature Reference DOI 10.3390/molecules18032589
Molecular Weight 456.709 g/mol
Solvent CDCl3
Source File Reference UWBT8914