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(Q83038852)
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Dienone B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
322.879267284
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₇Br₂NO₃
0 references
canonical SMILES
NC(=O)CC1(O)C=C(Br)C(=O)C(Br)=C1
0 references
found in taxon
Aplysina aerophoba
3 references
stated in
Cytotoxicity and mode of action of aeroplysinin-1 and a related dienonefrom the sponge Aplysina aerophoba.
stated in
Chemistry of verongida sponges VIII1-bromocompounds from the mediterranean sponges Aplysina aerophoba and Aplysina cavernicola
stated in
The bromo-compounds of the true spongeVerongia aerophoba
Pseudoceratina durissima
1 reference
stated in
Two Epimeric Dibromo Nitriles From the Australian Sponge Aplysina laevis
Pseudoceratina purpurea
1 reference
stated in
Dibromotyrosine Derivatives, a Maleimide, Aplysamine-2 and Other Constituents of the Marine Sponge Pseudoceratina purpurea
Identifiers
InChI
InChI=1S/C8H7Br2NO3/c9-4-1-8(14,3-6(11)12)2-5(10)7(4)13/h1-2,14H,3H2,(H2,11,12)
0 references
InChIKey
OPJJYFWUWHEWDE-UHFFFAOYSA-N
0 references
CAS Registry Number
17194-81-9
0 references
PubChem CID
100324
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
OPJJYFWUWHEWDE-UHFFFAOYSA-N
UniChem compound ID
72836
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10169192
1 reference
matched by identifier from
InChIKey
InChIKey
OPJJYFWUWHEWDE-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID6091683
0 references
NSC number
289074
0 references
UNII
8V0PDK5CGM
1 reference
matched by identifier from
InChIKey
InChIKey
OPJJYFWUWHEWDE-UHFFFAOYSA-N
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