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10-HYDROXYCORREANTHOSIDE;#7;[11S-(11-ALPHA,12-BETA,12A-ALPHA,13A-BETA)]-12-ETHENYL-11-(BETA-D-GLUCOPYRANOSYLOXY)-1,2,3,11,12,12A,13,13A-OCTAHYDRO-5-HYDROXY-1-
SpectraBase Compound ID 4RPuaMKoxvt
InChI InChI=1S/C27H32N2O9/c1-3-13-15-9-19-21-14(6-7-28(19)2)16-8-12(31)4-5-18(16)29(21)25(35)17(15)11-36-26(13)38-27-24(34)23(33)22(32)20(10-30)37-27/h3-5,8,11,13,15,19-20,22-24,26-27,30-34H,1,6-7,9-10H2,2H3/t13-,15+,19-,20-,22-,23+,24-,26+,27+/m0/s1
InChIKey LKLHDOVDGQHBEC-KEZSHUERSA-N
Mol Weight 528.6 g/mol
Molecular Formula C27H32N2O9
Exact Mass 528.210781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Fg6DQYaFFw
Name 10-HYDROXYCORREANTHOSIDE;#7;[11S-(11-ALPHA,12-BETA,12A-ALPHA,13A-BETA)]-12-ETHENYL-11-(BETA-D-GLUCOPYRANOSYLOXY)-1,2,3,11,12,12A,13,13A-OCTAHYDRO-5-HYDROXY-1-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32N2O9
InChI InChI=1S/C27H32N2O9/c1-3-13-15-9-19-21-14(6-7-28(19)2)16-8-12(31)4-5-18(16)29(21)25(35)17(15)11-36-26(13)38-27-24(34)23(33)22(32)20(10-30)37-27/h3-5,8,11,13,15,19-20,22-24,26-27,30-34H,1,6-7,9-10H2,2H3/t13-,15+,19-,20-,22-,23+,24-,26+,27+/m0/s1
InChIKey LKLHDOVDGQHBEC-KEZSHUERSA-N
Literature Reference Author H.ACHENBACH,M.LOTTES,R.WAIBEL,G.A.KARIKAS,M.D.CORREA,M.P.GUP TA
Literature Reference Citation PHYTOCHEM.,38,1537(1995)
Literature Reference DOI 10.1016/0031-9422(94)00823-C
Molecular Weight 528.559 g/mol
Solvent CD3OD
Source File Reference UWMS4100