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(1.alpha.,2.alpha.,3.alpha.,4.alpha.,5.alpha.,6.alpha.,7.alpha.,8.alpha.,9.alpha.,14.alpha.)-4,5-Di(acetoxymethyl)pentacyclo[6.6.2.2(3,6).0(2,7).0(9,14)]octadeca-11,15,17-trien-10,13-dione isomer

View entire compound with spectra: 1 MS (GC)

(1.alpha.,2.alpha.,3.alpha.,4.alpha.,5.alpha.,6.alpha.,7.alpha.,8.alpha.,9.alpha.,14.alpha.)-4,5-Di(acetoxymethyl)pentacyclo[6.6.2.2(3,6).0(2,7).0(9,14)]octadeca-11,15,17-trien-10,13-dione isomer
SpectraBase Compound ID JrsVk2G8bF1
InChI InChI=1S/C24H26O6/c1-11(25)29-9-17-13-3-4-14(18(17)10-30-12(2)26)22-16-6-5-15(21(13)22)23-19(27)7-8-20(28)24(16)23/h3-8,13-18,21-24H,9-10H2,1-2H3/t13-,14+,15-,16+,17+,18-,21-,22+,23-,24+
InChIKey KGOLJAQHVROXNA-NJIODOFGSA-N
Mol Weight 410.47 g/mol
Molecular Formula C24H26O6
Exact Mass 410.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pVRu7GO4jQ
Name (1.alpha.,2.alpha.,3.alpha.,4.alpha.,5.alpha.,6.alpha.,7.alpha.,8.alpha.,9.alpha.,14.alpha.)-4,5-Di(acetoxymethyl)pentacyclo[6.6.2.2(3,6).0(2,7).0(9,14)]octadeca-11,15,17-trien-10,13-dione isomer
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Formula C24H26O6
InChI InChI=1S/C24H26O6/c1-11(25)29-9-17-13-3-4-14(18(17)10-30-12(2)26)22-16-6-5-15(21(13)22)23-19(27)7-8-20(28)24(16)23/h3-8,13-18,21-24H,9-10H2,1-2H3/t13-,14+,15-,16+,17+,18-,21-,22+,23-,24+
InChIKey KGOLJAQHVROXNA-NJIODOFGSA-N
Molecular Weight 410.466 g/mol
SMILES [C@]12([C@]([C@]3([H])C=C[C@]2([C@]2([C@@]3(C(=O)C=CC2=O)[H])[H])[H])([C@@]2([H])C=C[C@@]1([C@@]([C@@]2(COC(=O)C)[H])(COC(=O)C)[H])[H])[H])[H]
SPLASH splash10-03di-0900000000-c9c5ab4029405cc09c82
Source of Spectrum F-51-2919-21
Wiley ID 791386