1-methoxy-9H-carbazole-3-carboxylic acid

Details

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Internal ID 71348572-66bc-44d2-91bd-ae3e2d071636
Taxonomy Organoheterocyclic compounds > Indoles and derivatives > Carbazoles
IUPAC Name 1-methoxy-9H-carbazole-3-carboxylic acid
SMILES (Canonical) COC1=CC(=CC2=C1NC3=CC=CC=C32)C(=O)O
SMILES (Isomeric) COC1=CC(=CC2=C1NC3=CC=CC=C32)C(=O)O
InChI InChI=1S/C14H11NO3/c1-18-12-7-8(14(16)17)6-10-9-4-2-3-5-11(9)15-13(10)12/h2-7,15H,1H3,(H,16,17)
InChI Key VZOALRHIINZPKX-UHFFFAOYSA-N
Popularity 7 references in papers

Physical and Chemical Properties

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Molecular Formula C14H11NO3
Molecular Weight 241.24 g/mol
Exact Mass 241.07389321 g/mol
Topological Polar Surface Area (TPSA) 62.30 Ų
XlogP 2.90

Synonyms

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3889-89-2
NSC654276
CHEMBL498081
DTXSID901275954
NSC-654276
NCI60_018840
9H-Carbazole-3-carboxylic acid, 1-methoxy-

2D Structure

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2D Structure of 1-methoxy-9H-carbazole-3-carboxylic acid

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 94.37% 95.56%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.48% 96.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 92.78% 91.11%
CHEMBL2535 P11166 Glucose transporter 92.68% 98.75%
CHEMBL1293249 Q13887 Kruppel-like factor 5 89.52% 86.33%
CHEMBL1255126 O15151 Protein Mdm4 88.95% 90.20%
CHEMBL3060 Q9Y345 Glycine transporter 2 87.96% 99.17%
CHEMBL213 P08588 Beta-1 adrenergic receptor 86.96% 95.56%
CHEMBL2581 P07339 Cathepsin D 86.09% 98.95%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 83.41% 99.23%
CHEMBL4208 P20618 Proteasome component C5 83.40% 90.00%
CHEMBL1287628 Q9Y5S8 NADPH oxidase 1 82.72% 95.48%
CHEMBL2716 Q8WUI4 Histone deacetylase 7 82.21% 89.44%
CHEMBL3091268 Q92753 Nuclear receptor ROR-beta 80.12% 95.50%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 80.11% 96.00%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Murraya euchrestifolia
Murraya koenigii

Cross-Links

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PubChem 375142
NPASS NPC184408
ChEMBL CHEMBL498081
LOTUS LTS0138272
wikiData Q105299881