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(+)-3ALPHA-(2Z-HEPTENYL)-2BETA-(3ALPHA,BETA-HYDROXY-7-ETHOXYCARBONYL-2E-HEPTENYL)-1ALPHA,4ALPHA-BIS(BENZOYLOXY)CYCLOPENTANE (ISOMER MIXTURE)

View entire compound with spectra: 1 NMR

(+)-3ALPHA-(2Z-HEPTENYL)-2BETA-(3ALPHA,BETA-HYDROXY-7-ETHOXYCARBONYL-2E-HEPTENYL)-1ALPHA,4ALPHA-BIS(BENZOYLOXY)CYCLOPENTANE (ISOMER MIXTURE)
SpectraBase Compound ID 1XLKrjJ5p73
InChI InChI=1S/C36H46O7/c1-3-5-6-7-14-22-30-31(25-24-29(37)21-15-16-23-34(38)41-4-2)33(43-36(40)28-19-12-9-13-20-28)26-32(30)42-35(39)27-17-10-8-11-18-27/h7-14,17-20,24-25,29-33,37H,3-6,15-16,21-23,26H2,1-2H3/b14-7-,25-24+/t29?,30-,31-,32+,33-/m0/s1
InChIKey JMTZTJJQPNGMFA-ASHRTQKWSA-N
Mol Weight 590.8 g/mol
Molecular Formula C36H46O7
Exact Mass 590.324354 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9HSW4dlC0mG
Name (+)-3ALPHA-(2Z-HEPTENYL)-2BETA-(3ALPHA,BETA-HYDROXY-7-ETHOXYCARBONYL-2E-HEPTENYL)-1ALPHA,4ALPHA-BIS(BENZOYLOXY)CYCLOPENTANE (ISOMER MIXTURE)
Comments A
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C36H46O7
InChI InChI=1S/C36H46O7/c1-3-5-6-7-14-22-30-31(25-24-29(37)21-15-16-23-34(38)41-4-2)33(43-36(40)28-19-12-9-13-20-28)26-32(30)42-35(39)27-17-10-8-11-18-27/h7-14,17-20,24-25,29-33,37H,3-6,15-16,21-23,26H2,1-2H3/b14-7-,25-24+/t29?,30-,31-,32+,33-/m0/s1
InChIKey JMTZTJJQPNGMFA-ASHRTQKWSA-N
Instrument Name Bruker AM-300
Literature Reference G.A.TOLSTIKOV, R.R.AKHMETVALEEV, V.M.ZHURBA, M.S.MIFTAKHOV (1992)Zhurn.Org.Khim.(Russ. Lang.): v.28, N9, 1862-1869.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d