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(2,4-CIS)-GONIOTHALAMICINONE

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(2,4-CIS)-GONIOTHALAMICINONE
SpectraBase Compound ID HVZZaBksvyT
InChI InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(38)33-23-24-34(42-33)32(39)22-21-29(37)18-15-14-16-19-30-26-28(25-27(2)36)35(40)41-30/h28-34,37-39H,3-26H2,1-2H3/t28-,29-,30+,31-,32-,33-,34-/m1/s1
InChIKey DZWITTGSSIGAEW-OUONLOLPSA-N
Mol Weight 596.9 g/mol
Molecular Formula C35H64O7
Exact Mass 596.465204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9cpogKEbjRY
Name (2,4-CIS)-GONIOTHALAMICINONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H64O7
InChI InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-31(38)33-23-24-34(42-33)32(39)22-21-29(37)18-15-14-16-19-30-26-28(25-27(2)36)35(40)41-30/h28-34,37-39H,3-26H2,1-2H3/t28-,29-,30+,31-,32-,33-,34-/m1/s1
InChIKey DZWITTGSSIGAEW-OUONLOLPSA-N
Literature Reference Author Q.YE,L.ZENG,Y.ZHANG,G.X.ZHAO,J.L.MCLAUGHLIN,M.H.WOO,D.R.EVER T
Literature Reference Citation J.NAT.PROD.,58,1398(1995)
Literature Reference DOI 10.1021/np50123a010
Molecular Weight 596.889 g/mol
Solvent Unknown
Source File Reference UWCS23171