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BRASIMARIN-B
SpectraBase Compound ID IDbpi7mNMUM
InChI InChI=1S/C25H26O6/c1-5-13(2)21(27)20-22(28)16-11-17(25(3,4)29)30-23(16)19-15(12-18(26)31-24(19)20)14-9-7-6-8-10-14/h6-10,12-13,17,28-29H,5,11H2,1-4H3
InChIKey NSWHDVGYGYSKPN-UHFFFAOYSA-N
Mol Weight 422.48 g/mol
Molecular Formula C25H26O6
Exact Mass 422.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9QcbLDNGvG0
Name BRASIMARIN-B
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26O6
InChI InChI=1S/C25H26O6/c1-5-13(2)21(27)20-22(28)16-11-17(25(3,4)29)30-23(16)19-15(12-18(26)31-24(19)20)14-9-7-6-8-10-14/h6-10,12-13,17,28-29H,5,11H2,1-4H3
InChIKey NSWHDVGYGYSKPN-UHFFFAOYSA-N
Literature Reference Author C.ITO,M.ITOIGAWA,Y.MISHINA,V.C.FILHO,F.ENJO,H.TOKUDA,H.NISHI NO,H.FURUKAWA
Literature Reference Citation J.NAT.PROD.,66,368(2003)
Literature Reference DOI 10.1021/np0203640
Molecular Weight 422.478 g/mol
Solvent CDCl3
Source File Reference UWSI4626