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3,20-ALPHA-DIHYDROXY-24,29-DINOR-1(10),3,5,7-FRIEDELATETRAENE-2,21-DIONE;20-HYDROXYTINGENONE
SpectraBase Compound ID EKgRPvRNHkl
InChI InChI=1S/C28H36O4/c1-16-17-7-8-20-25(3,18(17)13-19(29)23(16)31)10-12-27(5)21-14-28(6,32)22(30)15-24(21,2)9-11-26(20,27)4/h7-8,13,21,31-32H,9-12,14-15H2,1-6H3/t21-,24+,25+,26-,27+,28+/m1/s1
InChIKey LLINHWDEBZOLGN-UNQYGWCUSA-N
Mol Weight 436.6 g/mol
Molecular Formula C28H36O4
Exact Mass 436.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HD0hKBBKnX
Name 3,20-ALPHA-DIHYDROXY-24,29-DINOR-1(10),3,5,7-FRIEDELATETRAENE-2,21-DIONE;20-HYDROXYTINGENONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36O4
InChI InChI=1S/C28H36O4/c1-16-17-7-8-20-25(3,18(17)13-19(29)23(16)31)10-12-27(5)21-14-28(6,32)22(30)15-24(21,2)9-11-26(20,27)4/h7-8,13,21,31-32H,9-12,14-15H2,1-6H3/t21-,24+,25+,26-,27+,28+/m1/s1
InChIKey LLINHWDEBZOLGN-UNQYGWCUSA-N
Literature Reference Author U.SOTANAPHUN,R.SUTTISRI,V.LIPIPUN,R.BAVOVADA
Literature Reference Citation PHYTOCHEM.,49,1749(1998)
Literature Reference DOI 10.1016/S0031-9422(98)00290-8
Molecular Weight 436.591 g/mol
Solvent CDCl3
Source File Reference UWLU675