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BISPOLIDE-B2A

View entire compound with spectra: 1 NMR

BISPOLIDE-B2A
SpectraBase Compound ID EC8MB9REY1f
InChI InChI=1S/C63H103O19/c1-14-42-22-20-24-44(16-3)60(36(7)49(65)31-62(73)33-53(47(19-6)38(9)79-62)81-82-35-51(67)59(72)58(71)41(82)12)77-54(68)28-26-43(15-2)23-21-25-45(17-4)61(78-55(69)29-27-42)37(8)50(66)32-63(74-13)34-52(46(18-5)39(10)80-63)76-56-30-48(64)57(70)40(11)75-56/h20-29,36-41,44-53,56-61,64-67,70-73H,14-19,30-35H2,1-13H3/b24-20+,25-21+,28-26+,29-27+,42-22+,43-23+
InChIKey IUDYHBDAJHWYQU-WPAPVDTESA-N
Mol Weight 1164.5 g/mol
Molecular Formula C63H103O19
Exact Mass 1163.709356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EhNdiWuNGm3
Name BISPOLIDE-B2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C63H103O19
InChI InChI=1S/C63H103O19/c1-14-42-22-20-24-44(16-3)60(36(7)49(65)31-62(73)33-53(47(19-6)38(9)79-62)81-82-35-51(67)59(72)58(71)41(82)12)77-54(68)28-26-43(15-2)23-21-25-45(17-4)61(78-55(69)29-27-42)37(8)50(66)32-63(74-13)34-52(46(18-5)39(10)80-63)76-56-30-48(64)57(70)40(11)75-56/h20-29,36-41,44-53,56-61,64-67,70-73H,14-19,30-35H2,1-13H3/b24-20+,25-21+,28-26+,29-27+,42-22+,43-23+
InChIKey IUDYHBDAJHWYQU-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 1164.499 g/mol
Solvent ACETONE-D6
Source File Reference UWDB1160