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(2R,5R,6R,7S)-Germacra-1(10)E,4(15)-dien-5-hydroperoxy-2,6-diol-2-acetate
SpectraBase Compound ID EAy6cM9qUw
InChI InChI=1S/C17H28O5/c1-10(2)15-7-6-11(3)8-14(21-13(5)18)9-12(4)17(22-20)16(15)19/h8,10,14-17,19-20H,4,6-7,9H2,1-3,5H3/b11-8+/t14-,15-,16+,17+/m0/s1
InChIKey YOWABXYMBGIQEY-ISFSCYEMSA-N
Mol Weight 312.41 g/mol
Molecular Formula C17H28O5
Exact Mass 312.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID aUx2J767SZ
Name (2R,5R,6R,7S)-GERMACRA-1(10)E,4(15)-DIEN-5-HYDROPEROXY-2,6-DIOL-2-ACETATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H28O5
InChI InChI=1S/C17H28O5/c1-10(2)15-7-6-11(3)8-14(21-13(5)18)9-12(4)17(22-20)16(15)19/h8,10,14-17,19-20H,4,6-7,9H2,1-3,5H3/b11-8+/t14-,15-,16+,17+/m0/s1
InChIKey YOWABXYMBGIQEY-ISFSCYEMSA-N
Literature Reference Author G.APPENDINO,G.AVIELLO,M.BALLERO,F.BORRELLI,E.FATTORUSSO,F.PE TRUCCI,F.U.SANTELIA,
Literature Reference Citation J.NAT.PROD.,68,853(2005)
Literature Reference DOI 10.1021/np050120q
Molecular Weight 312.406 g/mol
Solvent CDCl3
Source File Reference UWMZ10618