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(Q55759135)
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English
harmalane
chemical compound
1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole
harmalan
1-methyl-3,4-dihydro-beta-carboline
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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chemical structure
Harmalane.svg
375 × 245; 21 KB
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mass
184.2375
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₂N₂
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canonical SMILES
CC1=C2C(=C3C=CC=CC3=N2)CCN1
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Identifiers
InChI
InChI=1S/C12H12N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-5,13H,6-7H2,1H3
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InChIKey
BJRYQXFFBCGJRM-UHFFFAOYSA-N
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CAS Registry Number
525-41-7
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PubChem CID
5316718
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DSSTox substance ID
DTXSID80966938
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DSSTOX compound identifier
DTXCID601394553
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