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KRUKOVINE-E;17-HYDROXY-28-NOR-URS-12-ENE-3,11-DIONE
SpectraBase Compound ID KrW8mz7teQE
InChI InChI=1S/C29H44O3/c1-17-8-13-29(32)15-14-27(6)19(23(29)18(17)2)16-20(30)24-26(5)11-10-22(31)25(3,4)21(26)9-12-28(24,27)7/h16-18,21,23-24,32H,8-15H2,1-7H3/t17-,18+,21+,23+,24-,26+,27-,28-,29+/m1/s1
InChIKey ZTILFJMHCZASCV-KDSNIASYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C29H44O3
Exact Mass 440.329045 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5M33NHptWOK
Name KRUKOVINE-E;17-HYDROXY-28-NOR-URS-12-ENE-3,11-DIONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H44O3
InChI InChI=1S/C29H44O3/c1-17-8-13-29(32)15-14-27(6)19(23(29)18(17)2)16-20(30)24-26(5)11-10-22(31)25(3,4)21(26)9-12-28(24,27)7/h16-18,21,23-24,32H,8-15H2,1-7H3/t17-,18+,21+,23+,24-,26+,27-,28-,29+/m1/s1
InChIKey ZTILFJMHCZASCV-KDSNIASYSA-N
Literature Reference Author O.SHIROTA,T.TAMEMURA,H.MORITA,K.TAKEYA,H.ITOKAWA
Literature Reference Citation J.NAT.PROD.,59,1072(1996)
Literature Reference DOI 10.1021/np960390w
Molecular Weight 440.667 g/mol
Solvent CDCl3
Source File Reference UWVP669