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1.beta.,6.alpha.12-Triacetoxy-4.alpha.-hydroxy-5.alpha.,11.beta.-H-eudesmane
SpectraBase Compound ID JBLTJNLXTPs
InChI InChI=1S/C21H34O7/c1-12(11-26-13(2)22)16-7-9-20(5)17(27-14(3)23)8-10-21(6,25)19(20)18(16)28-15(4)24/h12,16-19,25H,7-11H2,1-6H3/t12-,16?,17-,18+,19-,20+,21-/m1/s1
InChIKey KQYPBAARYLQQDC-JTSCPRIMSA-N
Mol Weight 398.5 g/mol
Molecular Formula C21H34O7
Exact Mass 398.230453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJTpYYT6A02
Name 1.beta.,6.alpha.12-Triacetoxy-4.alpha.-hydroxy-5.alpha.,11.beta.-H-eudesmane
Alternate Name(s) (1R,4R,4aS,5S,8aR)-5-(acetyloxy)-6-[(1S)-2-(acetyloxy)-1-methylethyl]-4-hydroxy-4,8a-dimethyldecahydro-1-naphthalenyl acetate
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Formula C21H34O7
InChI InChI=1S/C21H34O7/c1-12(11-26-13(2)22)16-7-9-20(5)17(27-14(3)23)8-10-21(6,25)19(20)18(16)28-15(4)24/h12,16-19,25H,7-11H2,1-6H3/t12-,16?,17-,18+,19-,20+,21-/m1/s1
InChIKey KQYPBAARYLQQDC-JTSCPRIMSA-N
Molecular Weight 398.496 g/mol
SMILES O[C@]1([C@]2([C@]([C@](OC(=O)C)(CC1)[H])(CCC([C@@]2(OC(=O)C)[H])[C@@](COC(=O)C)(C)[H])C)[H])C
SPLASH splash10-03e9-0095000000-54f3a047c88af55d744a
Source of Spectrum F-50-2926-16
Wiley ID 1368378