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STELLETIN_L;(13-E,15-E,17-E,22-E,24-E)-3-BETA-HYDROXY-12-OXO-ISOMALABARICA-13,15,17,22,24-PENTAEN-26-OIC_ACID
SpectraBase Compound ID 1L7sAXdcSZF
InChI InChI=1S/C30H42O4/c1-19(11-9-13-21(3)27(33)34)10-8-12-20(2)26-22(31)18-24-29(6)17-15-25(32)28(4,5)23(29)14-16-30(24,26)7/h8-13,23-25,32H,14-18H2,1-7H3,(H,33,34)/b11-9+,12-8+,19-10+,21-13+,26-20-/t23-,24-,25-,29-,30-/m0/s1
InChIKey HQKNXSLBDXDYEF-ZMTCAJFBSA-N
Mol Weight 466.7 g/mol
Molecular Formula C30H42O4
Exact Mass 466.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6P4gZGfiF1N
Name STELLETIN_L;(13-E,15-E,17-E,22-E,24-E)-3-BETA-HYDROXY-12-OXO-ISOMALABARICA-13,15,17,22,24-PENTAEN-26-OIC_ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42O4
InChI InChI=1S/C30H42O4/c1-19(11-9-13-21(3)27(33)34)10-8-12-20(2)26-22(31)18-24-29(6)17-15-25(32)28(4,5)23(29)14-16-30(24,26)7/h8-13,23-25,32H,14-18H2,1-7H3,(H,33,34)/b11-9+,12-8+,19-10+,21-13+,26-20-/t23-,24-,25-,29-,30-/m0/s1
InChIKey HQKNXSLBDXDYEF-ZMTCAJFBSA-N
Literature Reference Author H.W.LIN,Z.L.WANG,J.H.WU,N.SHI,H.J.ZHANG,W.S.CHEN,S.L.MORRIS- NATSCHKE,A.S.LIN
Literature Reference Citation J.NAT.PROD.,70,1114(2007)
Literature Reference DOI 10.1021/np070069l
Molecular Weight 466.661 g/mol
Sample ID 30694
Solvent CDCl3