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PHLOMISOSIDE-I
SpectraBase Compound ID U4ojMuoLwv
InChI InChI=1S/C32H50O11/c1-16-6-9-21-31(3,4)22(10-12-32(21,5)19(16)8-7-18-11-13-39-15-18)42-30-28(26(37)24(35)20(14-33)41-30)43-29-27(38)25(36)23(34)17(2)40-29/h11,13,15,17,20-30,33-38H,6-10,12,14H2,1-5H3/t17-,20+,21?,22-,23-,24+,25+,26-,27+,28+,29-,30-,32+/m0/s1
InChIKey FAASKPMBDMDYGK-DECVYOKBSA-N
Mol Weight 610.7 g/mol
Molecular Formula C32H50O11
Exact Mass 610.335312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDjPFm5pH6t
Name PHLOMISOSIDE-I
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H50O11
InChI InChI=1S/C32H50O11/c1-16-6-9-21-31(3,4)22(10-12-32(21,5)19(16)8-7-18-11-13-39-15-18)42-30-28(26(37)24(35)20(14-33)41-30)43-29-27(38)25(36)23(34)17(2)40-29/h11,13,15,17,20-30,33-38H,6-10,12,14H2,1-5H3/t17-,20+,21?,22-,23-,24+,25+,26-,27+,28+,29-,30-,32+/m0/s1
InChIKey FAASKPMBDMDYGK-DECVYOKBSA-N
Literature Reference Author M.KATAGIRI,K.OHTANI,R.KASAI,K.YAMASAKI,C.R.YANG,O.TANAKA
Literature Reference Citation PHYTOCHEM.,35,439(1994)
Literature Reference DOI 10.1016/S0031-9422(00)94777-0
Molecular Weight 610.742 g/mol
Solvent C5D5N
Source File Reference UWSI21282