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BISPOLIDE-A1

View entire compound with spectra: 1 NMR

BISPOLIDE-A1
SpectraBase Compound ID 50toN3YtiBl
InChI InChI=1S/C62H100O18/c1-13-41-21-19-23-43(15-3)59(35(7)49(65)31-61(71)33-51(45(17-5)37(9)79-61)75-55-29-47(63)57(69)39(11)73-55)78-54(68)28-26-42(14-2)22-20-24-44(16-4)60(77-53(67)27-25-41)36(8)50(66)32-62(72)34-52(46(18-6)38(10)80-62)76-56-30-48(64)58(70)40(12)74-56/h19-28,35-40,43-52,55-60,63-66,69-72H,13-18,29-34H2,1-12H3/b23-19+,24-20+,27-25+,28-26+,41-21+,42-22+
InChIKey IBGIBLZLQOOATI-BOZWHHKLSA-N
Mol Weight 1133.5 g/mol
Molecular Formula C62H100O18
Exact Mass 1132.690966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5HxHVb3ysJS
Name BISPOLIDE-A1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H100O18
InChI InChI=1S/C62H100O18/c1-13-41-21-19-23-43(15-3)59(35(7)49(65)31-61(71)33-51(45(17-5)37(9)79-61)75-55-29-47(63)57(69)39(11)73-55)78-54(68)28-26-42(14-2)22-20-24-44(16-4)60(77-53(67)27-25-41)36(8)50(66)32-62(72)34-52(46(18-6)38(10)80-62)76-56-30-48(64)58(70)40(12)74-56/h19-28,35-40,43-52,55-60,63-66,69-72H,13-18,29-34H2,1-12H3/b23-19+,24-20+,27-25+,28-26+,41-21+,42-22+
InChIKey IBGIBLZLQOOATI-BOZWHHKLSA-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 1133.465 g/mol
Solvent ACETONE-D6
Source File Reference UWDB1156