John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=700Xip9Ft4A SpectraBase Spectrum ID=1kQU1KE1Lrb

(accessed ).
SESTERSTATIN-7;16-BETA-ACETOXYSCALAROLIDE
SpectraBase Compound ID 700Xip9Ft4A
InChI InChI=1S/C27H40O5/c1-15(28)32-17-12-20-26(5)11-8-18-24(2,3)9-7-10-25(18,4)19(26)13-21(29)27(20,6)22-16(17)14-31-23(22)30/h17-21,29H,7-14H2,1-6H3/t17-,18-,19+,20-,21+,25-,26+,27+/m0/s1
InChIKey LOCDSBKFSVHNIV-XPSVZDKBSA-N
Mol Weight 444.6 g/mol
Molecular Formula C27H40O5
Exact Mass 444.287575 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1kQU1KE1Lrb
Name SESTERSTATIN-7;16-BETA-ACETOXYSCALAROLIDE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O5
InChI InChI=1S/C27H40O5/c1-15(28)32-17-12-20-26(5)11-8-18-24(2,3)9-7-10-25(18,4)19(26)13-21(29)27(20,6)22-16(17)14-31-23(22)30/h17-21,29H,7-14H2,1-6H3/t17-,18-,19+,20-,21+,25-,26+,27+/m0/s1
InChIKey LOCDSBKFSVHNIV-XPSVZDKBSA-N
Literature Reference Author D.T.A.YOUSSEF,L.A.SHAALA,S.EMARA
Literature Reference Citation J.NAT.PROD.,68,1782(2005)
Literature Reference DOI 10.1021/np0502645
Molecular Weight 444.612 g/mol
Solvent CDCl3
Source File Reference UWMZ12337
SpectraBase Batch ID IpH94t9qRVC