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AUROVERTIN_B;6-[(1-E,3-E,5-E)-6-[8-ACETYLOXY-7-ETHYL-4-HYDROXY-1,5-DIMETHYL-2,6-DIOXABICYCLO-[3.2.1]-OCT-3-YL]-1,3,5-HEXATRIENYL]-
SpectraBase Compound ID EIvLZnkPaTJ
InChI InChI=1S/C25H32O8/c1-7-20-24(4)23(30-16(3)26)25(5,33-20)22(28)18(32-24)13-11-9-8-10-12-17-15(2)19(29-6)14-21(27)31-17/h8-14,18,20,22-23,28H,7H2,1-6H3/b9-8+,12-10+,13-11+/t18-,20-,22-,23+,24+,25+/m0/s1
InChIKey QXCOFYWOWZJFEA-MHEICYKSSA-N
Mol Weight 460.5 g/mol
Molecular Formula C25H32O8
Exact Mass 460.209718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HLo7zDtS0Ut
Name AUROVERTIN_B;6-[(1-E,3-E,5-E)-6-[8-ACETYLOXY-7-ETHYL-4-HYDROXY-1,5-DIMETHYL-2,6-DIOXABICYCLO-[3.2.1]-OCT-3-YL]-1,3,5-HEXATRIENYL]-
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H32O8
InChI InChI=1S/C25H32O8/c1-7-20-24(4)23(30-16(3)26)25(5,33-20)22(28)18(32-24)13-11-9-8-10-12-17-15(2)19(29-6)14-21(27)31-17/h8-14,18,20,22-23,28H,7H2,1-6H3/b9-8+,12-10+,13-11+/t18-,20-,22-,23+,24+,25+/m0/s1
InChIKey QXCOFYWOWZJFEA-MHEICYKSSA-N
Literature Reference Author F.WANG,D.Q.LUO,J.K.LIU
Literature Reference Citation J.ANTIBIOTICS,58,412(2005)
Literature Reference DOI 10.1038/ja.2005.53
Molecular Weight 460.524 g/mol
Sample ID 42104
Solvent CDCl3