John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4NCAK6GmShD SpectraBase Spectrum ID=7tH7sPKHZgk

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BrASILIENSOPHYLLIC-ACID-C
SpectraBase Compound ID 4NCAK6GmShD
InChI InChI=1S/C36H46O6/c1-21(2)14-15-26(18-23(5)6)20-36(17-16-22(3)4)34(40)30(28(19-29(37)38)27-12-10-9-11-13-27)33-31(35(36)41)32(39)24(7)25(8)42-33/h9-13,16,18,24-26,28,39H,1,14-15,17,19-20H2,2-8H3,(H,37,38)/t24-,25-,26?,28?,36?/m0/s1
InChIKey IEZRWOUYXURXGQ-ZHFYXXPFSA-N
Mol Weight 574.8 g/mol
Molecular Formula C36H46O6
Exact Mass 574.32944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7tH7sPKHZgk
Name BrASILIENSOPHYLLIC-ACID-C
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H46O6
InChI InChI=1S/C36H46O6/c1-21(2)14-15-26(18-23(5)6)20-36(17-16-22(3)4)34(40)30(28(19-29(37)38)27-12-10-9-11-13-27)33-31(35(36)41)32(39)24(7)25(8)42-33/h9-13,16,18,24-26,28,39H,1,14-15,17,19-20H2,2-8H3,(H,37,38)/t24-,25-,26?,28?,36?/m0/s1
InChIKey IEZRWOUYXURXGQ-ZHFYXXPFSA-N
Literature Reference Author F.COTTIGLIA,B.DHANAPAL,O.STICHER,J.HEILMANN
Literature Reference Citation J.NAT.PROD.,67,537(2004)
Literature Reference DOI 10.1021/np030438n
Molecular Weight 574.758 g/mol
Solvent CDCl3
Source File Reference UWMZ7075
SpectraBase Batch ID 1C0TwUSg2WI