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(+)-(1S,4S,4aR,8aS)-4a,8,8-Trimethyl-3-methylene4-((3S,4.xi.)-3,4,5-trihydroxy-3-methylpentyl)decahydro-1-naphthalenyl acetate

View entire compound with spectra: 1 MS (GC)

(+)-(1S,4S,4aR,8aS)-4a,8,8-Trimethyl-3-methylene4-((3S,4.xi.)-3,4,5-trihydroxy-3-methylpentyl)decahydro-1-naphthalenyl acetate
SpectraBase Compound ID HxyUg0bNClC
InChI InChI=1S/C22H38O5/c1-14-12-17(27-15(2)24)19-20(3,4)9-7-10-21(19,5)16(14)8-11-22(6,26)18(25)13-23/h16-19,23,25-26H,1,7-13H2,2-6H3/t16-,17-,18?,19?,21+,22-/m0/s1
InChIKey NGQIUEGNFOOGEM-JXSXFBSMSA-N
Mol Weight 382.5 g/mol
Molecular Formula C22H38O5
Exact Mass 382.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xqnISEciJH
Name (+)-(1S,4S,4aR,8aS)-4a,8,8-Trimethyl-3-methylene4-((3S,4.xi.)-3,4,5-trihydroxy-3-methylpentyl)decahydro-1-naphthalenyl acetate
Alternate Name(s) 1-[(1S,4S,8aR)-4-(acetyloxy)-5,5,8a-trimethyl-2-methylenedecahydro-1-naphthalenyl]-1,2-dideoxy-3-C-methyl-D-glycero-pentitol
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Formula C22H38O5
InChI InChI=1S/C22H38O5/c1-14-12-17(27-15(2)24)19-20(3,4)9-7-10-21(19,5)16(14)8-11-22(6,26)18(25)13-23/h16-19,23,25-26H,1,7-13H2,2-6H3/t16-,17-,18?,19?,21+,22-/m0/s1
InChIKey NGQIUEGNFOOGEM-JXSXFBSMSA-N
Molecular Weight 382.541 g/mol
SMILES OC(CO)[C@](CC[C@@]1([C@@]2(C([C@@](OC(=O)C)(CC1=C)[H])C(C)(C)CCC2)C)[H])(O)C
SPLASH splash10-0006-6931000000-30047767d5d37c07e2fa
Source of Spectrum KC-57-5670-9
Wiley ID 1624770