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Cedronolactone D
SpectraBase Compound ID 5YdNpSZc1kd
InChI InChI=1S/C20H26O8/c1-7-4-9(21)15(25)18(2)8(7)5-10(22)20-6-27-19(3)14(20)12(24)17(26)28-16(19)11(23)13(18)20/h4,8,10-16,22-25H,5-6H2,1-3H3/t8-,10+,11+,12-,13+,14-,15+,16-,18-,19-,20+/m0/s1
InChIKey YBVSXIRROIXGQK-ZMVSGXBYSA-N
Mol Weight 394.42 g/mol
Molecular Formula C20H26O8
Exact Mass 394.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gr1AOPsUuqC
Name Cedronolactone D
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O8
InChI InChI=1S/C20H26O8/c1-7-4-9(21)15(25)18(2)8(7)5-10(22)20-6-27-19(3)14(20)12(24)17(26)28-16(19)11(23)13(18)20/h4,8,10-16,22-25H,5-6H2,1-3H3/t8-,10+,11+,12-,13+,14-,15+,16-,18-,19-,20+/m0/s1
InChIKey YBVSXIRROIXGQK-ZMVSGXBYSA-N
Molecular Weight 394.420 g/mol
SMILES O[C@@]1(C[C@]2(C(=CC([C@]([C@@]2([C@]2([C@]([C@@]3(OC([C@]([C@@]4([C@]12CO[C@]34C)[H])(O)[H])=O)[H])(O)[H])[H])C)(O)[H])=O)C)[H])[H]
SPLASH splash10-0ar3-5695000000-29d06e26ed9616f307c3
Source of Spectrum G4-61-779-4
Synonyms (1R,4S,5S,6S,9S,10R,11R,12S,13S,17S,19R)-6,10,13,19-tetrahydroxy-4,12,16-trimethyl-3,8-dioxapentacyclo[9.8.0.0(1,5).0(4,9).0(12,17)]nonadec-15-ene-7,14-dione
Wiley ID 1607311