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D:A-FRIEDO-24-NOROLEANA-1(10),3,5,7-TETRAEN-29-OIC ACID, 3-HYDROXY-2-OXO- METHYL ESTER,

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D:A-FRIEDO-24-NOROLEANA-1(10),3,5,7-TETRAEN-29-OIC ACID, 3-HYDROXY-2-OXO- METHYL ESTER,
SpectraBase Compound ID 9dGIc7xyXry
InChI InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3
InChIKey JFACETXYABVHFD-UHFFFAOYSA-N
Mol Weight 464.6 g/mol
Molecular Formula C30H40O4
Exact Mass 464.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 67HI9wfSJe6
Name Pristimerin
CAS Registry Number 1258-84-0
Comments REASSIGNED (A.HARDT)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H40O4
InChI InChI=1S/C30H40O4/c1-18-19-8-9-22-28(4,20(19)16-21(31)24(18)32)13-15-30(6)23-17-27(3,25(33)34-7)11-10-26(23,2)12-14-29(22,30)5/h8-9,16,23,32H,10-15,17H2,1-7H3
InChIKey JFACETXYABVHFD-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference K. Nakanishi, V.P. Gullo, I. Miura, J. Am. Chem. Soc. 95, 6473 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3