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(Q82900911)
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Butyrylmallotochromanol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chromane
0 references
mass
488.204632604
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₃₂O₉
0 references
canonical SMILES
O=C(C=1C(O)=C(C(OC)=C(C1O)CC2=C(O)C(C(=O)CCC)=C3OC(C)(C)C(O)CC3=C2O)C)C
0 references
found in taxon
Mallotus japonicus
3 references
stated in
Cytotoxic and antiherpetic activity of phloroglucinol derivatives from Mallotus japonicus (Euphorbiaceae)
stated in
Constituents of the Pericarps of Mallotus japonicus (Euphorbiaceae)
stated in
Studies on Cytotoxic Constituents in Pericarps of Mallotus japonicus, V. Three New Phloroglucinol Derivatives, Butyrylmallotochromanol, Isobutyrylmallotochromanol, and Mallotojaponol
Identifiers
InChI
InChI=1S/C26H32O9/c1-7-8-16(28)19-22(32)13(21(31)15-10-17(29)26(4,5)35-25(15)19)9-14-23(33)18(12(3)27)20(30)11(2)24(14)34-6/h17,29-33H,7-10H2,1-6H3
0 references
InChIKey
WZTNWSOEOKNXLK-UHFFFAOYSA-N
0 references
CAS Registry Number
129399-52-6
0 references
PubChem CID
179829
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WZTNWSOEOKNXLK-UHFFFAOYSA-N
UniChem compound ID
415505
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20926394
1 reference
matched by identifier from
InChIKey
InChIKey
WZTNWSOEOKNXLK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID501355209
0 references
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