John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Fhm7a5TUaTW SpectraBase Spectrum ID=2VEf1fpBwue

(accessed ).
NEGLIGNAN_F
SpectraBase Compound ID Fhm7a5TUaTW
InChI InChI=1S/C27H38O7/c1-14(2)13-34-23-16(4)15(3)10-17-11-20(29-5)25(31-7)26(32-8)21(17)22-18(23)12-19(28)24(30-6)27(22)33-9/h11-12,14-16,23,28H,10,13H2,1-9H3/t15-,16-,23+/m0/s1
InChIKey OSQUHJLUBNYFKD-PBPSECFOSA-N
Mol Weight 474.6 g/mol
Molecular Formula C27H38O7
Exact Mass 474.261754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VEf1fpBwue
Name NEGLIGNAN_F
Compound Number 6
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O7
InChI InChI=1S/C27H38O7/c1-14(2)13-34-23-16(4)15(3)10-17-11-20(29-5)25(31-7)26(32-8)21(17)22-18(23)12-19(28)24(30-6)27(22)33-9/h11-12,14-16,23,28H,10,13H2,1-9H3/t15-,16-,23+/m0/s1
InChIKey OSQUHJLUBNYFKD-PBPSECFOSA-N
Literature Reference Author X.M.GAO,R.R.WANG,D.Y.NIU,C.Y.MENG,L.M.YANG,Y.T.ZHENG,G.Y.YAN G,Q.F.HU,H.D.SUN,W.L
Literature Reference Citation J.NAT.PROD.,76,1052(2013)
Literature Reference DOI 10.1021/np400070x
Molecular Weight 474.595 g/mol
Sample ID 42610
Solvent CDCl3
SpectraBase Batch ID 3vExP04IUm2