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1,3,6-TRI-O-GALLOYL-BETA-D-ALLOPYRANOSIDE

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1,3,6-TRI-O-GALLOYL-BETA-D-ALLOPYRANOSIDE
SpectraBase Compound ID Ffl38bA7CZH
InChI InChI=1S/C27H24O18/c28-11-1-8(2-12(29)18(11)34)24(39)42-7-17-21(37)23(44-25(40)9-3-13(30)19(35)14(31)4-9)22(38)27(43-17)45-26(41)10-5-15(32)20(36)16(33)6-10/h1-6,17,21-23,27-38H,7H2/t17-,21-,22-,23-,27+/m1/s1
InChIKey RNKMOGIPOMVCHO-BTPAJHBMSA-N
Mol Weight 636.47 g/mol
Molecular Formula C27H24O18
Exact Mass 636.096264 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bu8KJbWq4QB
Name 1,3,6-TRI-O-GALLOYL-BETA-D-ALLOPYRANOSIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H24O18
InChI InChI=1S/C27H24O18/c28-11-1-8(2-12(29)18(11)34)24(39)42-7-17-21(37)23(44-25(40)9-3-13(30)19(35)14(31)4-9)22(38)27(43-17)45-26(41)10-5-15(32)20(36)16(33)6-10/h1-6,17,21-23,27-38H,7H2/t17-,21-,22-,23-,27+/m1/s1
InChIKey RNKMOGIPOMVCHO-BTPAJHBMSA-N
Literature Reference Author S.H.LEE,T.TANAKA,G.I.NONAKA,I.NISHIOKA,B.ZHANG
Literature Reference Citation PHYTOCHEM.,30,1251(1991)
Literature Reference DOI 10.1016/S0031-9422(00)95211-7
Molecular Weight 636.477 g/mol
Solvent ACETONE-D6:D2O
Source File Reference UWLU34258