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AMOMOL_A;2-ZETA,12-R-2-(2-HYDROXYHEPTADECYL)-2-METHOXY-1-OXASPIRO-[4.5]-DECA-6,9-DIEN-8-ONE
SpectraBase Compound ID 6gH2DTen0a
InChI InChI=1S/C27H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25(29)23-27(30-2)22-21-26(31-27)19-17-24(28)18-20-26/h17-20,25,29H,3-16,21-23H2,1-2H3/t25-,27?/m1/s1
InChIKey LOBKLUVDTHVJSR-CSMDKSQMSA-N
Mol Weight 434.7 g/mol
Molecular Formula C27H46O4
Exact Mass 434.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IgXfDe2psI2
Name AMOMOL_A;2-ZETA,12-R-2-(2-HYDROXYHEPTADECYL)-2-METHOXY-1-OXASPIRO-[4.5]-DECA-6,9-DIEN-8-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H46O4
InChI InChI=1S/C27H46O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25(29)23-27(30-2)22-21-26(31-27)19-17-24(28)18-20-26/h17-20,25,29H,3-16,21-23H2,1-2H3/t25-,27?/m1/s1
InChIKey LOBKLUVDTHVJSR-CSMDKSQMSA-N
Literature Reference Author Y.W.CHIN,A.A.SALIM,B.N.SU,Q.MI,H.B.CHAI,S.RISWAN,L.B.S.KARDO NO,A.RUSKANDI,N.R.FA
Literature Reference Citation J.NAT.PROD.,71,390(2008)
Literature Reference DOI 10.1021/np070584j
Molecular Weight 434.660 g/mol
Sample ID 27519
Solvent CDCl3