1-(furan-3-yl)-2-[4-(hydroxymethyl)-5,7a,7b-trimethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl]ethanol
Internal ID | 95c039ab-7c11-403d-8524-428278c08728 |
Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Colensane and clerodane diterpenoids |
IUPAC Name | 1-(furan-3-yl)-2-[4-(hydroxymethyl)-5,7a,7b-trimethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl]ethanol |
SMILES (Canonical) | CC1CCC2(C(C1(CC(C3=COC=C3)O)CO)CCC4C2(O4)C)C |
SMILES (Isomeric) | CC1CCC2(C(C1(CC(C3=COC=C3)O)CO)CCC4C2(O4)C)C |
InChI | InChI=1S/C20H30O4/c1-13-6-8-18(2)16(4-5-17-19(18,3)24-17)20(13,12-21)10-15(22)14-7-9-23-11-14/h7,9,11,13,15-17,21-22H,4-6,8,10,12H2,1-3H3 |
InChI Key | PZYXVRLXODTTQL-UHFFFAOYSA-N |
Popularity | 0 references in papers |
Molecular Formula | C20H30O4 |
Molecular Weight | 334.40 g/mol |
Exact Mass | 334.21440943 g/mol |
Topological Polar Surface Area (TPSA) | 66.10 Ų |
XlogP | 2.70 |
There are no found synonyms. |
![2D Structure of 1-(furan-3-yl)-2-[4-(hydroxymethyl)-5,7a,7b-trimethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl]ethanol 2D Structure of 1-(furan-3-yl)-2-[4-(hydroxymethyl)-5,7a,7b-trimethyl-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-4-yl]ethanol](https://plantaedb.com/storage/docs/compounds/2023/11/37ec17a0-8755-11ee-a8d4-2737c41c56cc.jpg)
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 |
---|---|---|---|---|
CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 96.33% | 97.25% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.96% | 96.09% |
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.17% | 91.11% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 91.43% | 94.45% |
CHEMBL3137262 | O60341 | LSD1/CoREST complex | 90.67% | 97.09% |
CHEMBL2581 | P07339 | Cathepsin D | 89.04% | 98.95% |
CHEMBL221 | P23219 | Cyclooxygenase-1 | 88.43% | 90.17% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.33% | 95.89% |
CHEMBL3492 | P49721 | Proteasome Macropain subunit | 85.18% | 90.24% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 83.72% | 95.56% |
CHEMBL5555 | O00767 | Acyl-CoA desaturase | 80.42% | 97.50% |
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.
To see more specific details click the taxa you are interested in.
Microglossa pyrrhopappa |
PubChem | 14707148 |
LOTUS | LTS0151853 |
wikiData | Q105217195 |