John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=KGU7OJj4ugV SpectraBase Spectrum ID=4BkAzvIjdOw

(accessed ).
PHLOMISOSIDE-IV;15,16-EPOXY-8,13(16),14-LABDATRIEN-19-OIC-ACID-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYLESTER
SpectraBase Compound ID KGU7OJj4ugV
InChI InChI=1S/C32H48O12/c1-16-6-9-21-31(3,19(16)8-7-18-10-13-40-15-18)11-5-12-32(21,4)30(39)44-29-27(25(37)23(35)20(14-33)42-29)43-28-26(38)24(36)22(34)17(2)41-28/h10,13,15,17,20-29,33-38H,5-9,11-12,14H2,1-4H3/t17-,20+,21?,22-,23+,24+,25-,26+,27+,28-,29-,31-,32+/m1/s1
InChIKey BQWRFUXUUCKOMZ-CZQQVOEUSA-N
Mol Weight 624.7 g/mol
Molecular Formula C32H48O12
Exact Mass 624.314577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4BkAzvIjdOw
Name PHLOMISOSIDE-IV;15,16-EPOXY-8,13(16),14-LABDATRIEN-19-OIC-ACID-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYLESTER
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H48O12
InChI InChI=1S/C32H48O12/c1-16-6-9-21-31(3,19(16)8-7-18-10-13-40-15-18)11-5-12-32(21,4)30(39)44-29-27(25(37)23(35)20(14-33)42-29)43-28-26(38)24(36)22(34)17(2)41-28/h10,13,15,17,20-29,33-38H,5-9,11-12,14H2,1-4H3/t17-,20+,21?,22-,23+,24+,25-,26+,27+,28-,29-,31-,32+/m1/s1
InChIKey BQWRFUXUUCKOMZ-CZQQVOEUSA-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 624.726 g/mol
Solvent C5D5N
Source File Reference UWSI21286
SpectraBase Batch ID 8mIfg1ZnQRG