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(1S*,3S*,4S*,7S*,8S*,11R*,14R*,12E)-3,4:7,8-DIEPOXYDOLABELL-12-ENE-14,18-DIOL
SpectraBase Compound ID F63W2rhPJdr
InChI InChI=1S/C20H32O4/c1-17(2,22)13-10-14(21)18(3)11-16-20(5,24-16)9-7-15-19(4,23-15)8-6-12(13)18/h10,12,14-16,21-22H,6-9,11H2,1-5H3/t12-,14+,15-,16-,18+,19-,20-/m1/s1
InChIKey DWWWEHGHMIJMAX-NUFZFFOSSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2bYcJyyRpZg
Name (1S*,4R*,5R*,8R*,9R*,11S*,12S*,13E)-4,5:8,9-Diepoxy-14-(1-hydroxy-1-methylethyl)-4,8,11-trimethylbicyclo[9.3.0]tetradec-13-en-12-ol
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Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-17(2,22)13-10-14(21)18(3)11-16-20(5,24-16)9-7-15-19(4,23-15)8-6-12(13)18/h10,12,14-16,21-22H,6-9,11H2,1-5H3/t12-,14+,15-,16-,18+,19-,20-/m1/s1
InChIKey DWWWEHGHMIJMAX-NUFZFFOSSA-N
Literature Reference DOI 10.1002/hlca.19910740822
Molecular Weight 336.472 g/mol
SMILES O[C@]1(C=C(C(O)(C)C)[C@@]2([C@]1(C)C[C@]1(O[C@@]1(CC[C@@]1([C@@](CC2)(O1)C)[H])C)[H])[H])[H]
SPLASH splash10-002g-4940000000-a2046aae847ac02d7e45
Source of Spectrum H-74-1807-2
Synonyms (1S*,3R*,4R*,7R*,8R*,11S*,14S*,12E)-3.4:7.8-Diepoxydolabell-12-ene-14,18-diol (1aR,3aR,4aR,5aS,6S,8aS,10aR)-8-(2-hydroxypropan-2-yl)-3a,5a,10a-trimethyl-1a,2,3,3a,4a,5,5a,6,8a,9,10,10a-dodecahydrocyclopenta[8,9]cycloundeca[1,2-b:5,6-b']bis(oxirene)-6-ol
Wiley ID 1789372