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KRUKOVINE-A;28-HYDROXYOLEAN-12-ENE-3,11-DIONE
SpectraBase Compound ID 5WBfuyx2Jfg
InChI InChI=1S/C30H46O3/c1-25(2)12-14-30(18-31)15-13-28(6)19(20(30)17-25)16-21(32)24-27(5)10-9-23(33)26(3,4)22(27)8-11-29(24,28)7/h16,20,22,24,31H,8-15,17-18H2,1-7H3/t20-,22-,24+,27-,28+,29+,30+/m0/s1
InChIKey QJCHSXDOPDGBSN-HBXFVAQRSA-N
Mol Weight 454.7 g/mol
Molecular Formula C30H46O3
Exact Mass 454.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kmxl9RbGdXc
Name KRUKOVINE-A;28-HYDROXYOLEAN-12-ENE-3,11-DIONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O3
InChI InChI=1S/C30H46O3/c1-25(2)12-14-30(18-31)15-13-28(6)19(20(30)17-25)16-21(32)24-27(5)10-9-23(33)26(3,4)22(27)8-11-29(24,28)7/h16,20,22,24,31H,8-15,17-18H2,1-7H3/t20-,22-,24+,27-,28+,29+,30+/m0/s1
InChIKey QJCHSXDOPDGBSN-HBXFVAQRSA-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 454.693 g/mol
Solvent CDCl3
Source File Reference UWVP665