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15,28-Dihydroxy-Lup-20(29)-en-3-one
SpectraBase Compound ID LBs1bHfggmh
InChI InChI=1S/C30H48O3/c1-18(2)19-10-15-30(17-31)16-24(33)29(7)20(25(19)30)8-9-22-27(5)13-12-23(32)26(3,4)21(27)11-14-28(22,29)6/h19-22,24-25,31,33H,1,8-17H2,2-7H3/t19-,20-,21-,22+,24?,25-,27-,28+,29-,30+/m0/s1
InChIKey FPJAYYQMRGEJMF-HGTVPWOSSA-N
Mol Weight 456.7 g/mol
Molecular Formula C30H48O3
Exact Mass 456.360345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9l0F4ee9wwN
Name 15,28-Dihydroxy-Lup-20(29)-en-3-one
Alternate Name(s) (13alpha,18beta)-15,28-dihydroxylup-20(30)-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H48O3
InChI InChI=1S/C30H48O3/c1-18(2)19-10-15-30(17-31)16-24(33)29(7)20(25(19)30)8-9-22-27(5)13-12-23(32)26(3,4)21(27)11-14-28(22,29)6/h19-22,24-25,31,33H,1,8-17H2,2-7H3/t19-,20-,21-,22+,24?,25-,27-,28+,29-,30+/m0/s1
InChIKey FPJAYYQMRGEJMF-HGTVPWOSSA-N
Molecular Weight 456.711 g/mol
SMILES OC1C[C@@]2(CO)CC[C@]([C@]2([C@@]2(CC[C@]3([C@]([C@]12C)(CC[C@]1(C(C(CC[C@]31C)=O)(C)C)[H])C)[H])[H])[H])(C(=C)C)[H]
SPLASH splash10-0a4u-3250900000-3e89d0e9252a217e9a5e
Source of Spectrum X2-55-397-3
Wiley ID 1604427