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REGEOL-A

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REGEOL-A
SpectraBase Compound ID GqFrtZvXqqA
InChI InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20?,21-,24-,25+,26-,27-,28+/m1/s1
InChIKey FKARAOWYAAUAFW-GZVNYUNISA-N
Mol Weight 440.6 g/mol
Molecular Formula C28H40O4
Exact Mass 440.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ZcLPHRmhSz
Name REGEOL-A;2,3,22-BETA-TRIHYDROXY-21-OXO-24,29-NOR-D:A-FRIEDOOLEANA-1,3,5(10)-TRIENE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H40O4
InChI InChI=1S/C28H40O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h14-15,20-21,24,29,31-32H,7-13H2,1-6H3/t15-,20?,21-,24-,25+,26-,27-,28+/m1/s1
InChIKey FKARAOWYAAUAFW-GZVNYUNISA-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 440.623 g/mol
Solvent CDCl3
Source File Reference UWPA1063