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(Q83084177)
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English
2H-1-Benzopyran-2-one, 5-hydroxy-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic coumarin
0 references
mass
162.031694052
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₆O₃
0 references
canonical SMILES
C1=CC(=C2C=CC(=O)OC2=C1)O
0 references
found in taxon
Hydrangea chinensis
1 reference
stated in
Hydrachine A, a novel alkaloid from the roots of Hydrangea chinensis
Petchia erythrocarpa
1 reference
stated in
Three monohydroxycoumarins from Alyxia lucida
Alyxia reinwardtii
1 reference
stated in
Three monohydroxycoumarins from Alyxia lucida
Identifiers
InChI
InChI=1S/C9H6O3/c10-7-2-1-3-8-6(7)4-5-9(11)12-8/h1-5,10H
0 references
InChIKey
CDHSCTCRBLLCBJ-UHFFFAOYSA-N
0 references
CAS Registry Number
6093-67-0
0 references
PubChem CID
5318179
1 reference
matched by identifier from
InChIKey
InChIKey
CDHSCTCRBLLCBJ-UHFFFAOYSA-N
ChEBI ID
193449
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C9H6O3/c10-7-2-1-3-8-6(7)4-5-9(11)12-8/h1-5,10H
SureChEMBL ID
SCHEMBL450134
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CDHSCTCRBLLCBJ-UHFFFAOYSA-N
UniChem compound ID
180777
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60209759
1 reference
matched by identifier from
InChIKey
InChIKey
CDHSCTCRBLLCBJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60132250
0 references
KNApSAcK ID
C00045576
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CDHSCTCRBLLCBJ-UHFFFAOYSA-N
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