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(E)-(3R,5S)-3,5-Dihydroxy-7-p-tolyl-hept-6-enoic acid-4,7,7-trimethyl-3-naphthalen-1-yl-bicyclo[2.2.1]hept-2-yl ester
SpectraBase Compound ID FOwX8G3acaU
InChI InChI=1S/C34H40O4/c1-22-12-14-23(15-13-22)16-17-25(35)20-26(36)21-30(37)38-32-29-18-19-34(4,33(29,2)3)31(32)28-11-7-9-24-8-5-6-10-27(24)28/h5-17,25-26,29,31-32,35-36H,18-21H2,1-4H3/b17-16+/t25-,26-,29+,31-,32+,34-/m1/s1
InChIKey ZZVQSBQWAHAMHJ-NDALYVBDSA-N
Mol Weight 512.7 g/mol
Molecular Formula C34H40O4
Exact Mass 512.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cCGFExvTNl
Name (E)-(3R,5S)-3,5-Dihydroxy-7-p-tolyl-hept-6-enoic acid-4,7,7-trimethyl-3-naphthalen-1-yl-bicyclo[2.2.1]hept-2-yl ester
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Formula C34H40O4
InChI InChI=1S/C34H40O4/c1-22-12-14-23(15-13-22)16-17-25(35)20-26(36)21-30(37)38-32-29-18-19-34(4,33(29,2)3)31(32)28-11-7-9-24-8-5-6-10-27(24)28/h5-17,25-26,29,31-32,35-36H,18-21H2,1-4H3/b17-16+/t25-,26-,29+,31-,32+,34-/m1/s1
InChIKey ZZVQSBQWAHAMHJ-NDALYVBDSA-N
Molecular Weight 512.690 g/mol
SMILES O[C@@](C[C@](CC(O[C@@]1([C@]([C@@]2(C([C@]1(CC2)[H])(C)C)C)(c1c2c(cccc2)ccc1)[H])[H])=O)(O)[H])(\C=C\c1ccc(cc1)C)[H]
SPLASH splash10-0c04-1930000000-298533ca1ff15f40dc58
Source of Spectrum AJ-68-359-14
Synonyms (4R)-4,7,7-Trimethyl-3-exo-(1-naphthyl)bicyclo[2.2.1]heptan-2-exo-yl (E,3S,5R)-3,5-dihydroxy-7-(4-merthylphenyl)-6-heptenoate 4,7,7-trimethyl-3-(1-naphthyl)bicyclo[2.2.1]hept-2-yl (3R,5S,6E)-3,5-dihydroxy-7-(4-methylphenyl)-6-heptenoate 4,7,7-Trimethyl-3-exo-(1-naphthyl)bicyclo[2.2.1]heptan-2-exo-yl (E,3R,5S)-3,5-dihydroxy-7-(4-methylphenyl)-6-heptenoate
Wiley ID 773011