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30-Hydroxylup-20(29)-en-3-one

View entire compound with spectra: 1 MS (GC)

30-Hydroxylup-20(29)-en-3-one
SpectraBase Compound ID FmuG1lelcnx
InChI InChI=1S/C30H48O2/c1-19(18-31)20-10-13-27(4)16-17-29(6)21(25(20)27)8-9-23-28(5)14-12-24(32)26(2,3)22(28)11-15-30(23,29)7/h20-23,25,31H,1,8-18H2,2-7H3
InChIKey ZUBZPUNHXGLZSQ-UHFFFAOYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C30H48O2
Exact Mass 440.365431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tCKivpRR90
Name 30-Hydroxylup-20(29)-en-3-one
CAS Registry Number 72944-06-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H48O2
InChI InChI=1S/C30H48O2/c1-19(18-31)20-10-13-27(4)16-17-29(6)21(25(20)27)8-9-23-28(5)14-12-24(32)26(2,3)22(28)11-15-30(23,29)7/h20-23,25,31H,1,8-18H2,2-7H3
InChIKey ZUBZPUNHXGLZSQ-UHFFFAOYSA-N
Molecular Weight 440.712 g/mol
SMILES OCC(C1C2C3C(C4(C(C5(CCC(C(C5CC4)(C)C)=O)C)CC3)C)(CCC2(CC1)C)C)=C
SPLASH splash10-0a4i-9080100000-a49adcdf88c9c61821ab
Source of Spectrum C-88-1108-2
Wiley ID 1590224