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(Q74417419)
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English
4-hydroxy-indole-3-carbonyl nitrile
chemical compound
4-hydroxyindole-3-carboxylic acid cyanide
4-hydroxy-α-oxo-1H-indole-3-acetonitrile
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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
indoles
0 references
chemical compound
0 references
tryptamine alkaloid
1 reference
based on heuristic
inferred from SMILES
part of
indole-3-carbonyl nitrile 4-hydroxylase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
mass
186.042927432
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₆N₂O₂
0 references
canonical SMILES
C1=CC2=C(C(=C1)O)C(=CN2)C(=O)C#N
0 references
Identifiers
InChI
InChI=1S/C10H6N2O2/c11-4-9(14)6-5-12-7-2-1-3-8(13)10(6)7/h1-3,5,12-13H
0 references
InChIKey
KVUDODPZCDAFRS-UHFFFAOYSA-N
2 references
stated in
ChEBI release 2019-11-01
stated in
ChEBI release 2020-09-01
CAS Registry Number
1809317-15-4
0 references
PubChem CID
122234931
1 reference
matched by identifier from
InChIKey
InChIKey
KVUDODPZCDAFRS-UHFFFAOYSA-N
ChEBI ID
142138
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C10H6N2O2/c11-4-9(14)6-5-12-7-2-1-3-8(13)10(6)7/h1-3,5,12-13H
UniChem compound ID
147843951
1 reference
stated in
UniChem
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