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REGEOL-C;2,3,7-TRIHYDROXY-6-OXO-24-NOR-D:A-FRIEDOOLEANA-1,3,5(10),7-TETRAENE-29-OIC-ACID
SpectraBase Compound ID LR0E66bcS9n
InChI InChI=1S/C29H38O6/c1-15-19-16(13-17(30)20(15)31)27(4)10-12-28(5)18-14-26(3,24(34)35)8-7-25(18,2)9-11-29(28,6)23(27)22(33)21(19)32/h13,18,30-31,33H,7-12,14H2,1-6H3,(H,34,35)/t18-,25-,26-,27+,28+,29-/m1/s1
InChIKey GXMSTEJLJKABOD-ZCICSXMVSA-N
Mol Weight 482.6 g/mol
Molecular Formula C29H38O6
Exact Mass 482.266839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JFCdSaOdtX9
Name REGEOL-C;2,3,7-TRIHYDROXY-6-OXO-24-NOR-D:A-FRIEDOOLEANA-1,3,5(10),7-TETRAENE-29-OIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H38O6
InChI InChI=1S/C29H38O6/c1-15-19-16(13-17(30)20(15)31)27(4)10-12-28(5)18-14-26(3,24(34)35)8-7-25(18,2)9-11-29(28,6)23(27)22(33)21(19)32/h13,18,30-31,33H,7-12,14H2,1-6H3,(H,34,35)/t18-,25-,26-,27+,28+,29-/m1/s1
InChIKey GXMSTEJLJKABOD-ZCICSXMVSA-N
Literature Reference Author Y.TAKAISHI,N.WARIISHI,H.TATEISHI,K.KAWAZOE,K.NAKANO,Y.ONO,H. TOKUDA,H.NISHINO,A.I
Literature Reference Citation PHYTOCHEM.,45,969(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00859-X
Molecular Weight 482.617 g/mol
Solvent C5D5N
Source File Reference UWPA1065