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(Q82645745)
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English
[(2,4,5,6,7-~2~H_5_)-1H-Indol-3-yl]acetic acid
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
180.094712258
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₉NO₂
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canonical SMILES
[2H]C1=C(C(=C2C(=C1[2H])C(=C(N2)[2H])CC(=O)O)[2H])[2H]
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Identifiers
InChI
InChI=1S/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)/i1D,2D,3D,4D,6D
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InChIKey
SEOVTRFCIGRIMH-SNOLXCFTSA-N
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CAS Registry Number
76937-78-5
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PubChem CID
54301591
1 reference
matched by identifier from
InChIKey
InChIKey
SEOVTRFCIGRIMH-SNOLXCFTSA-N
UniChem compound ID
45218647
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90710429
1 reference
matched by identifier from
InChIKey
InChIKey
SEOVTRFCIGRIMH-SNOLXCFTSA-N
DSSTOX compound identifier
DTXCID20661177
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