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(Q77383528)
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English
Halomadurone A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
305.998112696
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₃Cl₃O₂
0 references
canonical SMILES
O=C1C=C(OC(=C1)C(Cl)(Cl)Cl)C=CC(=CCC)C
0 references
isomeric SMILES
CC/C=C(\C)/C=C/C1=CC(=O)C=C(O1)C(Cl)(Cl)Cl
0 references
found in taxon
Actinomadura
1 reference
stated in
Activation of the nuclear factor E2-related factor 2 pathway by novel natural products halomadurones A-D and a synthetic analogue
Identifiers
InChI
InChI=1S/C13H13Cl3O2/c1-3-4-9(2)5-6-11-7-10(17)8-12(18-11)13(14,15)16/h4-8H,3H2,1-2H3/b6-5+,9-4+
0 references
InChIKey
YCTUQKCBFWAVPW-BZNITXMSSA-N
2 references
stated in
PubChem
PubChem CID
139585099
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
139585099
language of work or name
English
PubChem CID
139585099
2 references
stated in
PubChem
PubChem CID
139585099
language of work or name
English
matched by identifier from
InChIKey
InChIKey
YCTUQKCBFWAVPW-BZNITXMSSA-N
ChEBI ID
204073
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H13Cl3O2/c1-3-4-9(2)5-6-11-7-10(17)8-12(18-11)13(14,15)16/h4-8H,3H2,1-2H3/b6-5+,9-4+
UniChem compound ID
170908494
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA007122
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YCTUQKCBFWAVPW-BZNITXMSSA-N
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