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BISPOLIDE-B1
SpectraBase Compound ID 180DrOHomAQ
InChI InChI=1S/C62H100O19/c1-13-40-21-19-23-42(15-3)58(34(7)47(64)30-61(72)32-49(44(17-5)36(9)80-61)76-53-29-46(63)54(68)38(11)74-53)78-51(66)27-25-41(14-2)22-20-24-43(16-4)59(79-52(67)28-26-40)35(8)48(65)31-62(73)33-50(45(18-6)37(10)81-62)77-60-57(71)56(70)55(69)39(12)75-60/h19-28,34-39,42-50,53-60,63-65,68-73H,13-18,29-33H2,1-12H3/b23-19+,24-20+,27-25+,28-26+,40-21+,41-22+
InChIKey INCQULDVXZKQRX-IUTMBJBASA-N
Mol Weight 1149.5 g/mol
Molecular Formula C62H100O19
Exact Mass 1148.685881 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4BkjxxuaOek
Name BISPOLIDE-B1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H100O19
InChI InChI=1S/C62H100O19/c1-13-40-21-19-23-42(15-3)58(34(7)47(64)30-61(72)32-49(44(17-5)36(9)80-61)76-53-29-46(63)54(68)38(11)74-53)78-51(66)27-25-41(14-2)22-20-24-43(16-4)59(79-52(67)28-26-40)35(8)48(65)31-62(73)33-50(45(18-6)37(10)81-62)77-60-57(71)56(70)55(69)39(12)75-60/h19-28,34-39,42-50,53-60,63-65,68-73H,13-18,29-33H2,1-12H3/b23-19+,24-20+,27-25+,28-26+,40-21+,41-22+
InChIKey INCQULDVXZKQRX-IUTMBJBASA-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 1149.465 g/mol
Solvent ACETONE-D6
Source File Reference UWDB1159