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(+)-(1'R,6'R)-KRACHAIZIN-B

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(+)-(1'R,6'R)-KRACHAIZIN-B
SpectraBase Compound ID 4FPlZSiWhYo
InChI InChI=1S/C26H30O4/c1-17(2)8-7-9-18-12-13-21(22(14-18)19-10-5-4-6-11-19)26(29)25-23(28)15-20(27)16-24(25)30-3/h4-6,8,10-12,15-16,21-22,27-28H,7,9,13-14H2,1-3H3/t21-,22+/m1/s1
InChIKey YYSABONYZSVCIV-YADHBBJMSA-N
Mol Weight 406.52 g/mol
Molecular Formula C26H30O4
Exact Mass 406.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5oQUUmOQ4cu
Name Crinatusins C
Alternate Name(s) (2,4-Dihydroxy-6-methoxy-phenyl)-[(1R,6R)-4-(4-methyl-pent-3-enyl)-6-phenyl-cyclohex-3-enyl]-methanone (2,4-dihydroxy-6-methoxyphenyl)-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenyl-1-cyclohex-3-enyl]methanone (2,4-dihydroxy-6-methoxyphenyl)-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenylcyclohex-3-en-1-yl]methanone [2-methoxy-4,6-bis(oxidanyl)phenyl]-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenyl-cyclohex-3-en-1-yl]methanone
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Formula C26H30O4
InChI InChI=1S/C26H30O4/c1-17(2)8-7-9-18-12-13-21(22(14-18)19-10-5-4-6-11-19)26(29)25-23(28)15-20(27)16-24(25)30-3/h4-6,8,10-12,15-16,21-22,27-28H,7,9,13-14H2,1-3H3/t21-,22+/m1/s1
InChIKey YYSABONYZSVCIV-YADHBBJMSA-N
Molecular Weight 406.522 g/mol
SMILES Oc1cc(c(c(c1)O)C([C@]1([C@@](CC(=CC1)CCC=C(C)C)(c1ccccc1)[H])[H])=O)OC
SPLASH splash10-014i-2911300000-3a3dce3d37407aa212f3
Source of Spectrum F-56-8824-5
Wiley ID 859270