Basic information
- CAS
100108-66-5- Standard SMILES
CC1=CC(=O)c2[nH]c3ccccc3c2C1=O- InChIKey
XJTABSPWPMYLQX-UHFFFAOYSA-N- Molecular formula
- C13H9NO2
- Average molar mass
- 211.22 g/mol
- Monoisotopic mass
- 211.06332853
Overview
Murrayaquinone A has been reported in Murraya euchrestifolia and Murraya koenigii with data available.
Names & identifiers
- Preferred name
- Murrayaquinone A
- IUPAC
- 3-methyl-9H-carbazole-1,4-dione
- English name
- murrayaquinone A
- Molecular weight
- 0
Names & synonyms
Murrayaquinone A3-methyl-9H-carbazole-1,4-dione100108-66-5Murrayaquinone-ADTXSID10142945RefChem:926253DTXCID0065436Murrayachinon a3-Methyl-1H-carbazole-1,4(9H)-dioneCHEMBL396171SCHEMBL5396418XJTABSPWPMYLQX-UHFFFAOYSA-N
Show more names
NSC654274NSC-654274NCI60_0188381H-Carbazole-1,4(9H)-dione, 3-methyl-3-Methyl-1H-carbazole-1,4(9H)-dione #
Database identifiers
- CAS
100108-66-5- PubChem CID
- 127481
- DTXSID
DTXSID10142945- ChEMBL
CHEMBL396171- Nikkaji
- J327.348B
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 385
Chemistry & industry
Applications
DescriptionMurrayaquinone A is a carbazole alkaloid from Murraya (Rutaceae).
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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