(1R,11S)-1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene
Internal ID | 135c7b3a-c8fb-4515-b54e-732651c5af9a |
Taxonomy | Organoheterocyclic compounds > Epoxides |
IUPAC Name | (1R,11S)-1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene |
SMILES (Canonical) | CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C |
SMILES (Isomeric) | CC1=CCC(C=CC[C@@]2([C@@H](O2)CC1)C)(C)C |
InChI | InChI=1S/C15H24O/c1-12-6-7-13-15(4,16-13)10-5-9-14(2,3)11-8-12/h5,8-9,13H,6-7,10-11H2,1-4H3/t13-,15+/m0/s1 |
InChI Key | QTGAEXCCAPTGLB-DZGCQCFKSA-N |
Popularity | 0 references in papers |
Molecular Formula | C15H24O |
Molecular Weight | 220.35 g/mol |
Exact Mass | 220.182715385 g/mol |
Topological Polar Surface Area (TPSA) | 12.50 Ų |
XlogP | 3.80 |
There are no found synonyms. |
Target | Value | Probability (raw) | Probability (%) |
---|---|---|---|
No predicted properties yet! |
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 |
---|---|---|---|---|
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 91.11% | 91.11% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 89.13% | 96.09% |
CHEMBL1871 | P10275 | Androgen Receptor | 87.80% | 96.43% |
CHEMBL3137262 | O60341 | LSD1/CoREST complex | 86.65% | 97.09% |
CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 85.29% | 86.00% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.37% | 95.89% |
CHEMBL241 | Q14432 | Phosphodiesterase 3A | 82.84% | 92.94% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 82.28% | 89.00% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 82.00% | 95.56% |
CHEMBL1994 | P08235 | Mineralocorticoid receptor | 80.75% | 100.00% |
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.
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PubChem | 132587053 |
LOTUS | LTS0195579 |
wikiData | Q104253240 |