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6'-O-TRANS-P-COUMAROYL-2',3',4',4''-O-TETRAACETYL-8-EPIKINGISIDE
SpectraBase Compound ID EHRrskt7eCj
InChI InChI=1S/C34H38O17/c1-16-28-23(13-27(40)45-16)24(32(41)42-6)14-44-33(28)51-34-31(49-20(5)38)30(48-19(4)37)29(47-18(3)36)25(50-34)15-43-26(39)12-9-21-7-10-22(11-8-21)46-17(2)35/h7-12,14,16,23,25,28-31,33-34H,13,15H2,1-6H3/b12-9+/t16-,23?,25-,28?,29-,30+,31-,33+,34+/m0/s1
InChIKey QVKQPQGQIKVGDY-LIHLLSSLSA-N
Mol Weight 718.7 g/mol
Molecular Formula C34H38O17
Exact Mass 718.2109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4HI5fQQ8DTH
Name 6'-O-TRANS-P-COUMAROYL-2',3',4',4''-O-TETRAACETYL-8-EPIKINGISIDE
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H38O17
InChI InChI=1S/C34H38O17/c1-16-28-23(13-27(40)45-16)24(32(41)42-6)14-44-33(28)51-34-31(49-20(5)38)30(48-19(4)37)29(47-18(3)36)25(50-34)15-43-26(39)12-9-21-7-10-22(11-8-21)46-17(2)35/h7-12,14,16,23,25,28-31,33-34H,13,15H2,1-6H3/b12-9+/t16-,23?,25-,28?,29-,30+,31-,33+,34+/m0/s1
InChIKey QVKQPQGQIKVGDY-LIHLLSSLSA-N
Literature Reference Author H.LOPEZ,J.A.PEREZ,J.M.HERNANDEZ,J.TRUJILLO
Literature Reference Citation J.NAT.PROD.,60,1334(1997)
Literature Reference DOI 10.1021/np970272o
Molecular Weight 718.666 g/mol
Solvent CDCl3
Source File Reference WANG2446