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CRYPTOPORIC ACID C
SpectraBase Compound ID JvWeqiSI7eE
InChI InChI=1S/C45H68O14/c1-26-13-15-32-42(3,4)17-11-19-44(32,6)30(26)23-58-37(41(53)56-10)29(22-35(48)49)39(51)59-25-43(5)18-12-20-45(7)31(27(2)14-16-33(43)45)24-57-36(40(52)55-9)28(21-34(46)47)38(50)54-8/h28-33,36-37H,1-2,11-25H2,3-10H3,(H,46,47)(H,48,49)/t28-,29+,30+,31+,32?,33?,36-,37+,43+,44-,45-/m0/s1
InChIKey CWMFUDUBPHDHAX-AACWFAKDSA-N
Mol Weight 833.0 g/mol
Molecular Formula C45H68O14
Exact Mass 832.460907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1YrVvTnyeG4
Name CRYPTOPORIC ACID C
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Formula C45H68O14
InChI InChI=1S/C45H68O14/c1-26-13-15-32-42(3,4)17-11-19-44(32,6)30(26)23-58-37(41(53)56-10)29(22-35(48)49)39(51)59-25-43(5)18-12-20-45(7)31(27(2)14-16-33(43)45)24-57-36(40(52)55-9)28(21-34(46)47)38(50)54-8/h28-33,36-37H,1-2,11-25H2,3-10H3,(H,46,47)(H,48,49)/t28-,29+,30+,31+,32?,33?,36-,37+,43+,44-,45-/m0/s1
InChIKey CWMFUDUBPHDHAX-AACWFAKDSA-N
NMR Standard TMS
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