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CLAVULONE-III

View entire compound with spectra: 2 NMR

CLAVULONE-III
SpectraBase Compound ID GIsWuEeBUCs
InChI InChI=1S/C25H34O7/c1-5-6-7-8-9-10-17-25(32-20(3)27)18-16-23(28)22(25)13-11-12-21(31-19(2)26)14-15-24(29)30-4/h9-13,16,18,21H,5-8,14-15,17H2,1-4H3/b10-9-,12-11+,22-13+/t21-,25-/m0/s1
InChIKey QXSYLWTUKSQQCP-XJHMFZNOSA-N
Mol Weight 446.5 g/mol
Molecular Formula C25H34O7
Exact Mass 446.230453 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DbaVzPkxjZH
Name CLAVULONE-III
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H34O7
InChI InChI=1S/C25H34O7/c1-5-6-7-8-9-10-17-25(32-20(3)27)18-16-23(28)22(25)13-11-12-21(31-19(2)26)14-15-24(29)30-4/h9-13,16,18,21H,5-8,14-15,17H2,1-4H3/b10-9-,12-11+,22-13+/t21-,25-/m0/s1
InChIKey QXSYLWTUKSQQCP-XJHMFZNOSA-N
Literature Reference Author M.IWASHIMA,K.OKAMOTO,Y.MIYAI,K.IGUCHI
Literature Reference Citation CHEM.PHARM.BULL.,47,884(1999)
Literature Reference DOI 10.1248/cpb.47.884
Molecular Weight 446.541 g/mol
Solvent CDCl3
Source File Reference UWLU8084