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#3;ALTERPORRIOL-T;(1S*,2R*,3S*,4S*)-1,2,2'3,4,8,8'-HEPTAHYDROXY-6,6'-DIMETHOXY-3,3'-DIMETHYL-1,2,3,4-TETRAHYDRO-[5,5'-BIANTHRACENE]-9,9',10,10'-TETRAONE

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#3;ALTERPORRIOL-T;(1S*,2R*,3S*,4S*)-1,2,2'3,4,8,8'-HEPTAHYDROXY-6,6'-DIMETHOXY-3,3'-DIMETHYL-1,2,3,4-TETRAHYDRO-[5,5'-BIANTHRACENE]-9,9',10,10'-TETRAONE
SpectraBase Compound ID F9PwXUrWzZ8
InChI InChI=1S/C32H26O13/c1-9-5-10-11(6-12(9)33)25(36)17-13(34)7-15(44-3)19(21(17)26(10)37)20-16(45-4)8-14(35)18-22(20)28(39)24-23(27(18)38)29(40)31(42)32(2,43)30(24)41/h5-8,29-31,33-35,40-43H,1-4H3/t29-,30-,31+,32+/m0/s1
InChIKey YHXUFRJJYFYRSH-GASGPIRDSA-N
Mol Weight 618.5 g/mol
Molecular Formula C32H26O13
Exact Mass 618.137341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A9JT00e5MQS
Name #3;ALTERPORRIOL-T;(1S*,2R*,3S*,4S*)-1,2,2'3,4,8,8'-HEPTAHYDROXY-6,6'-DIMETHOXY-3,3'-DIMETHYL-1,2,3,4-TETRAHYDRO-[5,5'-BIANTHRACENE]-9,9',10,10'-TETRAONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H26O13
InChI InChI=1S/C32H26O13/c1-9-5-10-11(6-12(9)33)25(36)17-13(34)7-15(44-3)19(21(17)26(10)37)20-16(45-4)8-14(35)18-22(20)28(39)24-23(27(18)38)29(40)31(42)32(2,43)30(24)41/h5-8,29-31,33-35,40-43H,1-4H3/t29-,30-,31+,32+/m0/s1
InChIKey YHXUFRJJYFYRSH-GASGPIRDSA-N
Literature Reference Author B.CHEN,Q.SHEN,X.ZHU,Y.LIN
Literature Reference Citation MOLECULES,19,16529(2014)
Literature Reference DOI 10.3390/molecules191016529
Molecular Weight 618.551 g/mol
Solvent DMSO-D6
Source File Reference UWLU81490