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Acetic acid (R)-4-acetoxymethyl-3-((R)-acetoxymethyl)-5-((3aS,7aS)-4,4,7a-trimethyl-octahydro-inden-1-yl)-hex-5-enyl ester

View entire compound with spectra: 1 MS (GC)

Acetic acid (R)-4-acetoxymethyl-3-((R)-acetoxymethyl)-5-((3aS,7aS)-4,4,7a-trimethyl-octahydro-inden-1-yl)-hex-5-enyl ester
SpectraBase Compound ID DtyeZay3qey
InChI InChI=1S/C26H42O6/c1-17(23-9-10-24-25(5,6)12-8-13-26(23,24)7)22(16-32-20(4)29)21(15-31-19(3)28)11-14-30-18(2)27/h21-24H,1,8-16H2,2-7H3/t21-,22-,23?,24-,26+/m0/s1
InChIKey GNNFRICSQACMOM-NHCFEOAFSA-N
Mol Weight 450.6 g/mol
Molecular Formula C26H42O6
Exact Mass 450.298139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cJl1oAQ4ct
Name Acetic acid (R)-4-acetoxymethyl-3-((R)-acetoxymethyl)-5-((3aS,7aS)-4,4,7a-trimethyl-octahydro-inden-1-yl)-hex-5-enyl ester
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Formula C26H42O6
InChI InChI=1S/C26H42O6/c1-17(23-9-10-24-25(5,6)12-8-13-26(23,24)7)22(16-32-20(4)29)21(15-31-19(3)28)11-14-30-18(2)27/h21-24H,1,8-16H2,2-7H3/t21-,22-,23?,24-,26+/m0/s1
InChIKey GNNFRICSQACMOM-NHCFEOAFSA-N
Molecular Weight 450.616 g/mol
SMILES [C@@]12(C(C([C@](COC(=O)C)([C@](COC(=O)C)(CCOC(=O)C)[H])[H])=C)CC[C@]2(C(C)(C)CCC1)[H])C
SPLASH splash10-0ukc-0913000000-377411f9ee78221780db
Source of Spectrum X2-54-232-15
Synonyms (2R)-3-[(3aS,7aS)-4,4,7a-trimethyloctahydro-1H-inden-1-yl]-2-{(1R)-3-(acetyloxy)-1-[(acetyloxy)methyl]propyl}-3-butenyl acetate 8-[11'-Methylene-5'-(acetoxy)-2',3'-bis(acetoxymethyl)pentyl]-4,4,9-trimethylbicyclo[4.3.0]nonane Chelonaplysin c-diacetate
Wiley ID 1603891