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BISPOLIDE-A2

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BISPOLIDE-A2
SpectraBase Compound ID Azv3uhkj3Pc
InChI InChI=1S/C63H102O18/c1-14-42-22-20-24-44(16-3)60(36(7)50(66)32-62(72)34-52(46(18-5)38(9)80-62)76-56-30-48(64)58(70)40(11)74-56)78-54(68)28-26-43(15-2)23-21-25-45(17-4)61(79-55(69)29-27-42)37(8)51(67)33-63(73-13)35-53(47(19-6)39(10)81-63)77-57-31-49(65)59(71)41(12)75-57/h20-29,36-41,44-53,56-61,64-67,70-72H,14-19,30-35H2,1-13H3/b24-20+,25-21+,28-26+,29-27+,42-22+,43-23+
InChIKey OFYLDDSYNNQGMR-WPAPVDTESA-N
Mol Weight 1147.5 g/mol
Molecular Formula C63H102O18
Exact Mass 1146.706616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5NcD30Zz9aQ
Name BISPOLIDE-A2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C63H102O18
InChI InChI=1S/C63H102O18/c1-14-42-22-20-24-44(16-3)60(36(7)50(66)32-62(72)34-52(46(18-5)38(9)80-62)76-56-30-48(64)58(70)40(11)74-56)78-54(68)28-26-43(15-2)23-21-25-45(17-4)61(79-55(69)29-27-42)37(8)51(67)33-63(73-13)35-53(47(19-6)39(10)81-63)77-57-31-49(65)59(71)41(12)75-57/h20-29,36-41,44-53,56-61,64-67,70-72H,14-19,30-35H2,1-13H3/b24-20+,25-21+,28-26+,29-27+,42-22+,43-23+
InChIKey OFYLDDSYNNQGMR-WPAPVDTESA-N
Literature Reference Author N.OKUJO,H.IINUMA,A.GEORGE,K.S.EIM,T.L.LI,N.S.TING,T.C.JYE,K. HOTTA,M.HATSU,Y.FUKA
Literature Reference Citation J.ANTIBIOTICS,60,216(2007)
Literature Reference DOI 10.1038/ja.2007.26
Molecular Weight 1147.492 g/mol
Solvent ACETONE-D6
Source File Reference UWDB1157