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HYDROXYHEPTAFUHALOL-B-NONADECAACETATE
SpectraBase Compound ID HhfFjWbOetr
InChI InChI=1S/C80H68O44/c1-31(81)100-50-20-56(103-34(4)84)69(57(21-50)104-35(5)85)122-65-28-62(109-40(10)90)73(114-45(15)95)79(117-48(18)98)76(65)120-52-24-60(107-38(8)88)71(61(25-52)108-39(9)89)124-67-30-64(111-42(12)92)74(115-46(16)96)80(118-49(19)99)77(67)121-53-26-58(105-36(6)86)70(59(27-53)106-37(7)87)123-66-29-63(110-41(11)91)72(113-44(14)94)78(116-47(17)97)75(66)119-51-22-54(101-32(2)82)68(112-43(13)93)55(23-51)102-33(3)83/h20-30H,1-19H3
InChIKey RZUJQHDHMAHKDY-UHFFFAOYSA-N
Mol Weight 1733.4 g/mol
Molecular Formula C80H68O44
Exact Mass 1732.308345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ff45ZsIpnLs
Name HYDROXYHEPTAFUHALOL-B-NONADECAACETATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C80H68O44
InChI InChI=1S/C80H68O44/c1-31(81)100-50-20-56(103-34(4)84)69(57(21-50)104-35(5)85)122-65-28-62(109-40(10)90)73(114-45(15)95)79(117-48(18)98)76(65)120-52-24-60(107-38(8)88)71(61(25-52)108-39(9)89)124-67-30-64(111-42(12)92)74(115-46(16)96)80(118-49(19)99)77(67)121-53-26-58(105-36(6)86)70(59(27-53)106-37(7)87)123-66-29-63(110-41(11)91)72(113-44(14)94)78(116-47(17)97)75(66)119-51-22-54(101-32(2)82)68(112-43(13)93)55(23-51)102-33(3)83/h20-30H,1-19H3
InChIKey RZUJQHDHMAHKDY-UHFFFAOYSA-N
Literature Reference Author K.W.GLOMBITZA,A.SCHMIDT
Literature Reference Citation J.NAT.PROD.,62,1238(1999)
Literature Reference DOI 10.1021/np990076c
Molecular Weight 1733.394 g/mol
Solvent CDCl3
Source File Reference UWCP8624