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11R*-ACETOXYNEOClERODA-3,13-E-DIEN-15-OIC-ACID;11R*-ACETOXYKOLAVENIC-ACID
SpectraBase Compound ID CvCKqdgz1eX
InChI InChI=1S/C22H34O4/c1-14(13-20(24)25)12-19(26-17(4)23)22(6)16(3)10-11-21(5)15(2)8-7-9-18(21)22/h8,13,16,18-19H,7,9-12H2,1-6H3,(H,24,25)/b14-13+/t16-,18+,19+,21+,22+/m0/s1
InChIKey QMNGBVSRMNPSBB-HVVXFVLHSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jvto6eqenJw
Name 11R*-ACETOXYNEOClERODA-3,13-E-DIEN-15-OIC-ACID;11R*-ACETOXYKOLAVENIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-14(13-20(24)25)12-19(26-17(4)23)22(6)16(3)10-11-21(5)15(2)8-7-9-18(21)22/h8,13,16,18-19H,7,9-12H2,1-6H3,(H,24,25)/b14-13+/t16-,18+,19+,21+,22+/m0/s1
InChIKey QMNGBVSRMNPSBB-HVVXFVLHSA-N
Literature Reference Author P.M.OLIVEIRA,A.A.FERREIRA,D.SILVEIRA,R.B.ALVES,G.V.RODRIGUES ,V.P.EMERENCIANO,D.S
Literature Reference Citation J.NAT.PROD.,68,588(2005)
Literature Reference DOI 10.1021/np049827n
Molecular Weight 362.510 g/mol
Solvent CDCl3
Source File Reference UWMZ9603