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(Q77518766)
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English
Vertilecanin A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
5-[(Hydroxy)(phenyl)methyl]pyridine-2-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
229.073893212
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₁NO₃
0 references
canonical SMILES
O=C(O)C1=NC=C(C=C1)C(O)C=2C=CC=CC2
0 references
isomeric SMILES
C1=CC=C(C=C1)[C@H](C2=CN=C(C=C2)C(=O)O)O
0 references
found in taxon
Akanthomyces lecanii
1 reference
stated in
Vertilecanins: new phenopicolinic acid analogues from Verticillium lecanii
Identifiers
InChI
InChI=1S/C13H11NO3/c15-12(9-4-2-1-3-5-9)10-6-7-11(13(16)17)14-8-10/h1-8,12,15H,(H,16,17)/t12-/m1/s1
0 references
InChIKey
BMTGCDDXYNEVRV-GFCCVEGCSA-N
2 references
stated in
PubChem
PubChem CID
10263201
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
10263201
language of work or name
English
PubChem CID
10263201
2 references
stated in
PubChem
PubChem CID
10263201
language of work or name
English
matched by identifier from
InChIKey
InChIKey
BMTGCDDXYNEVRV-GFCCVEGCSA-N
ChEBI ID
209555
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H11NO3/c15-12(9-4-2-1-3-5-9)10-6-7-11(13(16)17)14-8-10/h1-8,12,15H,(H,16,17)/t12-/m1/s1
UniChem compound ID
608522
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA013996
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
BMTGCDDXYNEVRV-GFCCVEGCSA-N
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