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TELLIMAGRANDIN-I

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TELLIMAGRANDIN-I
SpectraBase Compound ID 1NAUK47kEmZ
InChI InChI=1S/C34H26O22/c35-12-1-8(2-13(36)21(12)41)30(47)55-28-27-18(53-34(51)29(28)56-31(48)9-3-14(37)22(42)15(38)4-9)7-52-32(49)10-5-16(39)23(43)25(45)19(10)20-11(33(50)54-27)6-17(40)24(44)26(20)46/h1-6,18,27-29,34-46,51H,7H2/t18-,27-,28+,29-,34+/m0/s1
InChIKey YKDNTEQLKGYZHT-QTUGGWJFSA-N
Mol Weight 786.6 g/mol
Molecular Formula C34H26O22
Exact Mass 786.091572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KfevCo7KM23
Name TELLIMAGRANDIN-I
Compound Number ALPHA-#9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H26O22
InChI InChI=1S/C34H26O22/c35-12-1-8(2-13(36)21(12)41)30(47)55-28-27-18(53-34(51)29(28)56-31(48)9-3-14(37)22(42)15(38)4-9)7-52-32(49)10-5-16(39)23(43)25(45)19(10)20-11(33(50)54-27)6-17(40)24(44)26(20)46/h1-6,18,27-29,34-46,51H,7H2/t18-,27-,28+,29-,34+/m0/s1
InChIKey YKDNTEQLKGYZHT-QTUGGWJFSA-N
Literature Reference Author N.KASAJIMA,H.ITO,T.HATANO,T.YOSHIDA
Literature Reference Citation PHYTOCHEM.,69,3080(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.03.003
Molecular Weight 786.567 g/mol
Sample ID 63866
Solvent ACETONE-D6:D2O