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NEMOROSIDE-I
SpectraBase Compound ID 5GnsZWgeBLj
InChI InChI=1S/C25H36O12/c1-12(6-8-26)4-3-5-13(2)22(32)35-20-14-7-9-33-23(16(14)25(11-28)21(20)37-25)36-24-19(31)18(30)17(29)15(10-27)34-24/h5-7,9,14-21,23-24,26-31H,3-4,8,10-11H2,1-2H3/b12-6+,13-5+/t14-,15+,16-,17+,18-,19+,20+,21+,23+,24-,25-/m1/s1
InChIKey IAGZLJOLJLDXTL-YUHZMLHOSA-N
Mol Weight 528.6 g/mol
Molecular Formula C25H36O12
Exact Mass 528.220677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CIvzTH6Kjhq
Name NEMOROSIDE;6-O-FOLIAMENTHOYL-CATAPOL
Compound Number 116
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O12
InChI InChI=1S/C25H36O12/c1-12(6-8-26)4-3-5-13(2)22(32)35-20-14-7-9-33-23(16(14)25(11-28)21(20)37-25)36-24-19(31)18(30)17(29)15(10-27)34-24/h5-7,9,14-21,23-24,26-31H,3-4,8,10-11H2,1-2H3/b12-6+,13-5+/t14-,15+,16-,17+,18-,19+,20+,21+,23+,24-,25-/m1/s1
InChIKey IAGZLJOLJLDXTL-YUHZMLHOSA-N
Literature Reference Author C.A.BOROS,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,53,1055(1990)
Literature Reference DOI 10.1021/np50071a001
Molecular Weight 528.554 g/mol
Solvent CD3OD
Source File Reference UWMZ16104