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(Q83128500)
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English
NAPHTHO(1,8-bc)PYRAN-7,8-DIONE, 6,9-DIMETHYL-3-(4-METHYL-3-PENTENYL)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
serrulatane diterpenoid
0 references
mass
308.1412445
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₀O₃
0 references
canonical SMILES
O=C1C(=O)C(=C2OC=C(C=3C=CC(=C1C23)C)CCC=C(C)C)C
0 references
found in taxon
Capraria biflora
2 references
stated in
Total assignments of1H and13C NMR spectra of biflorin and bis-biflorin fromCapraria biflora
stated in
Antitumor activity of biflorin, an o-naphthoquinone isolated from Capraria biflora
Identifiers
InChI
InChI=1S/C20H20O3/c1-11(2)6-5-7-14-10-23-20-13(4)18(21)19(22)16-12(3)8-9-15(14)17(16)20/h6,8-10H,5,7H2,1-4H3
0 references
InChIKey
DSVUOBIQVPVZST-UHFFFAOYSA-N
0 references
CAS Registry Number
99671-97-3
0 references
PubChem CID
57525
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DSVUOBIQVPVZST-UHFFFAOYSA-N
UniChem compound ID
531898
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90244198
1 reference
matched by identifier from
InChIKey
InChIKey
DSVUOBIQVPVZST-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID90166689
0 references
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