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STELLETTIC-ACID-A;(2S)-2-METHOXY-12-METHYLOCTADEC-17-EN-5-YNOIC-ACID
SpectraBase Compound ID AGtWPgrhX3B
InChI InChI=1S/C20H34O3/c1-4-5-6-12-15-18(2)16-13-10-8-7-9-11-14-17-19(23-3)20(21)22/h4,18-19H,1,5-8,10,12-17H2,2-3H3,(H,21,22)/t18?,19-/m0/s1
InChIKey QVPPXGQQEKCQFT-GGYWPGCISA-N
Mol Weight 322.5 g/mol
Molecular Formula C20H34O3
Exact Mass 322.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9spzOO8ei63
Name STELLETTIC-ACID-A;(2S)-2-METHOXY-12-METHYLOCTADEC-17-EN-5-YNOIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-4-5-6-12-15-18(2)16-13-10-8-7-9-11-14-17-19(23-3)20(21)22/h4,18-19H,1,5-8,10,12-17H2,2-3H3,(H,21,22)/t18?,19-/m0/s1
InChIKey QVPPXGQQEKCQFT-GGYWPGCISA-N
Literature Reference Author Q.ZHAO,S.Y.LEE,J.HONG,C.O.LEE,K.S.IM,C.J.SIM,D.S.LEE,J.H.JUN G
Literature Reference Citation J.NAT.PROD.,66,408(2003)
Literature Reference DOI 10.1021/np020440z
Molecular Weight 322.488 g/mol
Solvent CDCl3