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(5-S,8-R,9-R,10-S)-(-)-8-HYDROXY-7,8-SECO-7,8-OXACASSA-13,15-DIEN-7-OIC_ACID_EPSILON_LACTONE
SpectraBase Compound ID Izgj8vDYjeW
InChI InChI=1S/C20H30O2/c1-6-14-8-9-15-18(13(14)2)22-17(21)12-16-19(3,4)10-7-11-20(15,16)5/h6,15-16,18H,1,7-12H2,2-5H3/t15-,16-,18-,20+/m0/s1
InChIKey XBESYKWZMIDXOU-ZTTFOMCMSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DlI7nBKS1Rm
Name (5-S,8-R,9-R,10-S)-(-)-8-HYDROXY-7,8-SECO-7,8-OXACASSA-13,15-DIEN-7-OIC_ACID_EPSILON_LACTONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-6-14-8-9-15-18(13(14)2)22-17(21)12-16-19(3,4)10-7-11-20(15,16)5/h6,15-16,18H,1,7-12H2,2-5H3/t15-,16-,18-,20+/m0/s1
InChIKey XBESYKWZMIDXOU-ZTTFOMCMSA-N
Literature Reference Author J.J.MANRIQUEZ-TORRES,J.M.TORRES-VALENCIA,M.A.GOMEZ-HURTADO,V .MOTILVA,S.GARCIA-MA
Literature Reference Citation J.NAT.PROD.,74,1946(2011)
Literature Reference DOI 10.1021/np200445y
Molecular Weight 302.457 g/mol
Sample ID 39229
Solvent CDCl3