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(1S,4R,5S,6S,7S,10R)-1,15-Diacetoxy-4-hydroxyeudesm-11(13)-en-6,12-olide
SpectraBase Compound ID JOORVNr9V7H
InChI InChI=1S/C19H26O7/c1-10-13-5-7-18(4)14(25-12(3)21)6-8-19(23,9-24-11(2)20)16(18)15(13)26-17(10)22/h13-16,23H,1,5-9H2,2-4H3/t13-,14-,15-,16+,18-,19-/m0/s1
InChIKey VUVRYVOGGAELIO-NPWKVKMJSA-N
Mol Weight 366.41 g/mol
Molecular Formula C19H26O7
Exact Mass 366.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3o0Fij0vCa
Name (1S,4R,5S,6S,7S,10R)-1,15-Diacetoxy-4-hydroxyeudesm-11(13)-en-6,12-olide
Appearance Gum
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Formula C19H26O7
InChI InChI=1S/C19H26O7/c1-10-13-5-7-18(4)14(25-12(3)21)6-8-19(23,9-24-11(2)20)16(18)15(13)26-17(10)22/h13-16,23H,1,5-9H2,2-4H3/t13-,14-,15-,16+,18-,19-/m0/s1
InChIKey VUVRYVOGGAELIO-NPWKVKMJSA-N
Instrument Name Varian Saturn 2000
Ionization Type EI
Literature Reference DOI 10.1021/np070154t
Molecular Weight 366.410 g/mol
Optical Rotation [a]D = +55 (589 nm), +58 (578 nm), +68 (546 nm), +112 (436 nm), +172 (365 nm) (c = 0.72, CHCl3)
Reported Formula C19H26O7
SMILES O[C@@]1(CC[C@@]([C@@]2(CC[C@]3(C(C(O[C@@]3([C@@]12[H])[H])=O)=C)[H])C)(OC(C)=O)[H])COC(C)=O
SPLASH splash10-016d-2791000000-67f762319d2feed6b4a0
Source of Spectrum G4-70-1177-5
Wiley ID 1874586