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(Q105208435)
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English
6-(4,5-Dimethyl-6-oxo-2,3-dihydropyran-2-yl)-17-hydroxy-6,13-dimethyl-7,19-dioxahexacyclo[10.9.0.02,9.05,9.013,18.018,20]henicosane-8,14-dione
group of stereoisomers with the chemical formula C₂₈H₃₆O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
Withanolides
1 reference
inferred from
Withanolides
mass
484.246103492
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₃₆O₇
0 references
canonical SMILES
O=C1OC(CC(=C1C)C)C2(OC(=O)C34CCC5C(CC6OC76C(O)CCC(=O)C57C)C4CCC23)C
0 references
found in taxon
Acnistus arborescens
1 reference
stated in
Cytotoxic epimeric withaphysalins from leaves of Acnistus arborescens
Identifiers
InChI
InChI=1S/C28H36O7/c1-13-11-21(33-23(31)14(13)2)26(4)18-6-5-17-15-12-22-28(34-22)20(30)8-7-19(29)25(28,3)16(15)9-10-27(17,18)24(32)35-26/h15-18,20-22,30H,5-12H2,1-4H3
0 references
InChIKey
PGJRQHKPPYIVQE-UHFFFAOYSA-N
0 references
PubChem CID
73085594
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PGJRQHKPPYIVQE-UHFFFAOYSA-N
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