John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5B1U5Am1akw SpectraBase Spectrum ID=2bAfs4JQR2V

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EXCAVATOLIDE-W
SpectraBase Compound ID 5B1U5Am1akw
InChI InChI=1S/C27H38O10/c1-8-21(30)35-17-12-19(34-16(5)29)25(6)18(33-15(4)28)10-9-13(2)11-20-27(23(31)22(25)14(17)3)26(7,37-27)24(32)36-20/h11,14,17-20,22-23,31H,8-10,12H2,1-7H3/b13-11-/t14-,17-,18-,19-,20-,22+,23-,25-,26-,27-/m0/s1
InChIKey QBPHCUGJAMMXSE-GKECYSCXSA-N
Mol Weight 522.6 g/mol
Molecular Formula C27H38O10
Exact Mass 522.246498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bAfs4JQR2V
Name EXCAVATOLIDE-W
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O10
InChI InChI=1S/C27H38O10/c1-8-21(30)35-17-12-19(34-16(5)29)25(6)18(33-15(4)28)10-9-13(2)11-20-27(23(31)22(25)14(17)3)26(7,37-27)24(32)36-20/h11,14,17-20,22-23,31H,8-10,12H2,1-7H3/b13-11-/t14-,17-,18-,19-,20-,22+,23-,25-,26-,27-/m0/s1
InChIKey QBPHCUGJAMMXSE-GKECYSCXSA-N
Literature Reference Author J.H.SHEU,P.J.SUNG,J.H.SU,G.H.WANG,C.Y.DUH,Y.C.SHEN,M.Y.CHIAN G,I.T.CHEN
Literature Reference Citation J.NAT.PROD.,62,1415(1999)
Literature Reference DOI 10.1021/np990302i
Molecular Weight 522.593 g/mol
Solvent CDCl3
Source File Reference WANG1358
SpectraBase Batch ID I0EFy7V3f5u