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RAPUTIOLIDE;REL-(1S,5R,9S,7R,8S,9R,10S,11R,13S,14R,15R,17R)-11,19-DIHYDROXY-7-ACETOXY-7-DEOXO-ICHANGIN
SpectraBase Compound ID G2rsX7kyggb
InChI InChI=1S/C28H36O12/c1-12(29)37-17-8-15(24(2,3)35)27(16(31)9-18(32)38-23(27)34)19-14(30)10-25(4)20(13-6-7-36-11-13)39-22(33)21-28(25,40-21)26(17,19)5/h6-7,11,14-17,19-21,23,30-31,34-35H,8-10H2,1-5H3/t14-,15+,16+,17-,19+,20+,21-,23-,25+,26-,27+,28-/m1/s1
InChIKey XNAFLPSXVJJXFQ-HCPGKWEISA-N
Mol Weight 564.6 g/mol
Molecular Formula C28H36O12
Exact Mass 564.220677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9pZjpRXzkxX
Name RAPUTIOLIDE;REL-(1S,5R,9S,7R,8S,9R,10S,11R,13S,14R,15R,17R)-11,19-DIHYDROXY-7-ACETOXY-7-DEOXO-ICHANGIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H36O12
InChI InChI=1S/C28H36O12/c1-12(29)37-17-8-15(24(2,3)35)27(16(31)9-18(32)38-23(27)34)19-14(30)10-25(4)20(13-6-7-36-11-13)39-22(33)21-28(25,40-21)26(17,19)5/h6-7,11,14-17,19-21,23,30-31,34-35H,8-10H2,1-5H3/t14-,15+,16+,17-,19+,20+,21-,23-,25+,26-,27+,28-/m1/s1
InChIKey XNAFLPSXVJJXFQ-HCPGKWEISA-N
Literature Reference Author C.A.C.BARRERA,E.D.C.BARRERA,D.S.G.FALLA,G.D.MURCIA,L.E.C.SUA REZ
Literature Reference Citation CHEM.PHARM.BULL.,59,855(2011)
Literature Reference DOI 10.1248/cpb.59.855
Molecular Weight 564.587 g/mol
Source File Reference UWIR3405