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English
Bauerine B
bioactive natural product
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
beta-carboline alkaloid
0 references
mass
250.006453616
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₈Cl₂N₂
0 references
canonical SMILES
CN1C2=C(C=CN=C2)C3=C1C(=C(C=C3)Cl)Cl
0 references
found in taxon
Dichothrix baueriana
1 reference
stated in
beta-Carbolines from the blue-green alga Dichothrix baueriana.
Identifiers
InChI
InChI=1S/C12H8Cl2N2/c1-16-10-6-15-5-4-7(10)8-2-3-9(13)11(14)12(8)16/h2-6H,1H3
0 references
InChIKey
XGTYSLIGRKUXED-UHFFFAOYSA-N
2 references
stated in
PubChem
PubChem CID
189884
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
189884
language of work or name
English
CAS Registry Number
156312-10-6
1 reference
InChIKey
XGTYSLIGRKUXED-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=156312-10-6
PubChem CID
189884
2 references
stated in
PubChem
PubChem CID
189884
language of work or name
English
matched by identifier from
InChIKey
InChIKey
XGTYSLIGRKUXED-UHFFFAOYSA-N
ChEBI ID
217205
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H8Cl2N2/c1-16-10-6-15-5-4-7(10)8-2-3-9(13)11(14)12(8)16/h2-6H,1H3
UniChem compound ID
22108
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40166078
1 reference
matched by identifier from
InChIKey
InChIKey
XGTYSLIGRKUXED-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID8088569
0 references
KNApSAcK ID
C00052170
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XGTYSLIGRKUXED-UHFFFAOYSA-N
Natural Product Atlas ID
NPA011051
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XGTYSLIGRKUXED-UHFFFAOYSA-N
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