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Glaucarubin pentaacetate
SpectraBase Compound ID FW6wWeZ1hql
InChI InChI=1S/C35H46O15/c1-11-33(9,50-21(8)40)32(43)49-28-25-16(3)27(46-19(6)38)26(41)29-34(10)22(13-24(48-31(28)42)35(25,29)14-44-17(4)36)15(2)12-23(45-18(5)37)30(34)47-20(7)39/h12,16,22-25,27-30H,11,13-14H2,1-10H3/t16-,22+,23?,24+,25-,27?,28?,29-,30?,33?,34+,35-/m0/s1
InChIKey BTFRNPMGBRGGJI-BPYCUDBDSA-N
Mol Weight 706.7 g/mol
Molecular Formula C35H46O15
Exact Mass 706.283671 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JGzEho13WfV
Name Glaucarubin pentaacetate
CAS Registry Number 55606-58-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C35H46O15
InChI InChI=1S/C35H46O15/c1-11-33(9,50-21(8)40)32(43)49-28-25-16(3)27(46-19(6)38)26(41)29-34(10)22(13-24(48-31(28)42)35(25,29)14-44-17(4)36)15(2)12-23(45-18(5)37)30(34)47-20(7)39/h12,16,22-25,27-30H,11,13-14H2,1-10H3/t16-,22+,23?,24+,25-,27?,28?,29-,30?,33?,34+,35-/m0/s1
InChIKey BTFRNPMGBRGGJI-BPYCUDBDSA-N
Instrument Name Varian XL-100
Literature Reference J. Polonsky, Z. Baskevitch, E. Wenkert, J. Org. Chem. 40, 2499 (1975).
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6