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FLABELLIFERIN_A

View entire compound with spectra: 1 NMR

FLABELLIFERIN_A
SpectraBase Compound ID 3taOPx4ZcZL
InChI InChI=1S/C30H48O6/c1-18-23(16-24(34)22(19(2)31)11-15-35-20(3)32)29(7)14-10-26-28(5,6)12-9-13-30(26,8)27(29)17-25(18)36-21(4)33/h22-27,34H,1,9-17H2,2-8H3/t22-,23-,24+,25+,26+,27+,29+,30+/m1/s1
InChIKey VLBFZFAVJXGAFU-RFPDRPGHSA-N
Mol Weight 504.7 g/mol
Molecular Formula C30H48O6
Exact Mass 504.345089 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 579dx6jFLa3
Name FLABELLIFERIN_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O6
InChI InChI=1S/C30H48O6/c1-18-23(16-24(34)22(19(2)31)11-15-35-20(3)32)29(7)14-10-26-28(5,6)12-9-13-30(26,8)27(29)17-25(18)36-21(4)33/h22-27,34H,1,9-17H2,2-8H3/t22-,23-,24+,25+,26+,27+,29+,30+/m1/s1
InChIKey VLBFZFAVJXGAFU-RFPDRPGHSA-N
Literature Reference Author T.DIYABLANAGE,R.RATNAYAKE,H.R.BOKESCH,T.T.RANSOM,C.J.HENRICH ,J.A.BEUTLER,J.B.MCM
Literature Reference Citation J.NAT.PROD.,75,1490(2012)
Literature Reference DOI 10.1021/np3003518
Molecular Weight 504.708 g/mol
Sample ID 41389
Solvent CDCl3