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METHYL-17-HYDROXY-16-ALPHA-(-)-KAURAN-19-OATE
SpectraBase Compound ID 5TNjuFHhd8p
InChI InChI=1S/C21H34O3/c1-19-8-4-9-20(2,18(23)24-3)16(19)7-10-21-11-14(5-6-17(19)21)15(12-21)13-22/h14-17,22H,4-13H2,1-3H3/t14-,15+,16?,17?,19-,20-,21+/m1/s1
InChIKey HCXQUFPQHLFUCK-DYMNQNOCSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgNOl91n6Ww
Name Methyl 17-hydroxy-16.alpha.-kauran-19-oate
Alternate Name(s) Methyl (4beta,8alpha,10alpha)-17-hydroxykauran-18-oate
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Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-19-8-4-9-20(2,18(23)24-3)16(19)7-10-21-11-14(5-6-17(19)21)15(12-21)13-22/h14-17,22H,4-13H2,1-3H3/t14-,15+,16?,17?,19-,20-,21+/m1/s1
InChIKey HCXQUFPQHLFUCK-DYMNQNOCSA-N
Molecular Weight 334.500 g/mol
SMILES OC[C@@]1(C[C@@]23C([C@@]4(CCC[C@](C4CC3)(C(=O)OC)C)C)CC[C@@]1(C2)[H])[H]
SPLASH splash10-05e9-0985000000-48e598fb90cdab849d04
Source of Spectrum X2-50-983-13
Wiley ID 1602447