5,6-Dihydrobicolorine

Details

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Internal ID 17f035e1-71d3-491d-9ada-4f362a7a9039
Taxonomy Organoheterocyclic compounds > Quinolines and derivatives > Benzoquinolines > Phenanthridines and derivatives
IUPAC Name 5-methyl-6H-[1,3]dioxolo[4,5-j]phenanthridine
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H13NO2/c1-16-8-10-6-14-15(18-9-17-14)7-12(10)11-4-2-3-5-13(11)16/h2-7H,8-9H2,1H3
InChI Key WAZIYEFJZKKXBR-UHFFFAOYSA-N
Popularity 8 references in papers

Physical and Chemical Properties

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Molecular Formula C15H13NO2
Molecular Weight 239.27 g/mol
Exact Mass 239.094628657 g/mol
Topological Polar Surface Area (TPSA) 21.70 Ų
XlogP 3.10

Synonyms

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NSC654242
5-Methyl-5,6-dihydro[1,3]dioxolo[4,5-j]phenanthridine
5-methyl-6H-[1,3]dioxolo[4,5-j]phenanthridine
CHEMBL2005884
NSC-654242
NCI60_018834

2D Structure

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2D Structure of 5,6-Dihydrobicolorine

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
CHEMBL2581 P07339 Cathepsin D 96.62% 98.95%
CHEMBL1293249 Q13887 Kruppel-like factor 5 91.62% 86.33%
CHEMBL4303 P08238 Heat shock protein HSP 90-beta 91.33% 96.77%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 91.07% 95.56%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 89.88% 96.09%
CHEMBL4208 P20618 Proteasome component C5 89.20% 90.00%
CHEMBL5409 Q8TDU6 G-protein coupled bile acid receptor 1 88.37% 93.65%
CHEMBL5697 Q9GZT9 Egl nine homolog 1 87.65% 93.40%
CHEMBL5805 Q9NR97 Toll-like receptor 8 85.82% 96.25%
CHEMBL4481 P35228 Nitric oxide synthase, inducible 85.69% 94.80%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 83.72% 91.11%
CHEMBL6007 O75762 Transient receptor potential cation channel subfamily A member 1 82.08% 92.17%
CHEMBL1806 P11388 DNA topoisomerase II alpha 80.29% 89.00%
CHEMBL264 Q9Y5N1 Histamine H3 receptor 80.25% 91.43%

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.
Hymenocallis littoralis
Lycoris radiata
Narcissus bicolor
Narcissus tazetta
Zephyranthes candida

Cross-Links

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PubChem 375118
LOTUS LTS0207172
wikiData Q105300546