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(Q110183499)
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English
Deacetylviguiestin
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
germacrane sesquiterpenoid
1 reference
based on heuristic
inferred from SMILES
mass
350.172938552
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(1R,2R,4R,6R,8R,9Z,11R)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] 2-methylpropanoate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Tagitinin E
1 reference
based on heuristic
inferred from InChI
[(1S,2R,4S,6R,8S,9Z,11S)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] 2-methylpropanoate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₆O₆
0 references
canonical SMILES
O=C1OC2C=C(C)C(O)CC3OC3(C)CC(OC(=O)C(C)C)C2C1=C
0 references
isomeric SMILES
C=C1C(=O)O[C@@H]2/C=C(/C)[C@@H](O)C[C@@H]3O[C@@]3(C)C[C@@H](OC(=O)C(C)C)[C@@H]12
0 references
found in taxon
Tithonia diversifolia
1 reference
stated in
Sesquiterpenoids and flavonoids from the aerial parts of Tithonia diversifolia and their cytotoxic activity
Identifiers
InChI
InChI=1S/C19H26O6/c1-9(2)17(21)24-14-8-19(5)15(25-19)7-12(20)10(3)6-13-16(14)11(4)18(22)23-13/h6,9,12-16,20H,4,7-8H2,1-3,5H3/b10-6-/t12-,13+,14+,15-,16-,19-/m0/s1
0 references
InChIKey
QSOMGPFBPSJEFH-CTNCVWLFSA-N
0 references
PubChem CID
102322800
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QSOMGPFBPSJEFH-CTNCVWLFSA-N
UniChem compound ID
101023191
1 reference
stated in
UniChem
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