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Methyl 8.alpha.-(3',4'-dihydroxy-2'-methylenebutanoyloxy)-6.alpha.,15-dihydroxyelema-1,3,11(13)-trien-12-oate
SpectraBase Compound ID FWJrXY96T2t
InChI InChI=1S/C21H30O8/c1-7-21(5)8-15(29-20(27)12(3)14(24)10-23)16(13(4)19(26)28-6)18(25)17(21)11(2)9-22/h7,14-18,22-25H,1-4,8-10H2,5-6H3/t14?,15-,16?,17?,18-,21+/m0/s1
InChIKey PUUYULQKNFTVDK-OXSPMONKSA-N
Mol Weight 410.46 g/mol
Molecular Formula C21H30O8
Exact Mass 410.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLPlntOLEpD
Name Methyl 8.alpha.-(3',4'-dihydroxy-2'-methylenebutanoyloxy)-6.alpha.,15-dihydroxyelema-1,3,11(13)-trien-12-oate
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Formula C21H30O8
InChI InChI=1S/C21H30O8/c1-7-21(5)8-15(29-20(27)12(3)14(24)10-23)16(13(4)19(26)28-6)18(25)17(21)11(2)9-22/h7,14-18,22-25H,1-4,8-10H2,5-6H3/t14?,15-,16?,17?,18-,21+/m0/s1
InChIKey PUUYULQKNFTVDK-OXSPMONKSA-N
Molecular Weight 410.463 g/mol
SMILES OCC(C1[C@](C([C@@](OC(C(C(CO)O)=C)=O)(C[C@]1(C=C)C)[H])C(C(=O)OC)=C)(O)[H])=C
SPLASH splash10-004i-0090100000-c680155bb2d56f310608
Source of Spectrum U-1997-630-5
Wiley ID 769638