Isopimara-7,15-dien-3beta-ol
Internal ID | 2bec79e3-5303-4d5f-afe0-5a2f3fdc0041 |
Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Diterpenoids |
IUPAC Name | (2S,4aR,4bS,7S,10aR)-7-ethenyl-1,1,4a,7-tetramethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthren-2-ol |
SMILES (Canonical) | CC1(C(CCC2(C1CC=C3C2CCC(C3)(C)C=C)C)O)C |
SMILES (Isomeric) | C[C@@]1(CC[C@H]2C(=CC[C@@H]3[C@@]2(CC[C@@H](C3(C)C)O)C)C1)C=C |
InChI | InChI=1S/C20H32O/c1-6-19(4)11-9-15-14(13-19)7-8-16-18(2,3)17(21)10-12-20(15,16)5/h6-7,15-17,21H,1,8-13H2,2-5H3/t15-,16-,17-,19-,20+/m0/s1 |
InChI Key | BLRQCWSOICYRPH-VDWQKOAOSA-N |
Popularity | 3 references in papers |
Molecular Formula | C20H32O |
Molecular Weight | 288.50 g/mol |
Exact Mass | 288.245315640 g/mol |
Topological Polar Surface Area (TPSA) | 20.20 Ų |
XlogP | 5.30 |
CHEMBL225866 |
![2D Structure of Isopimara-7,15-dien-3beta-ol 2D Structure of Isopimara-7,15-dien-3beta-ol](https://plantaedb.com/storage/docs/compounds/2023/11/isopimara-715-dien-3beta-ol.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 |
---|---|---|---|---|
CHEMBL221 | P23219 | Cyclooxygenase-1 | 94.72% | 90.17% |
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 93.99% | 91.11% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 91.81% | 96.09% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 88.97% | 95.89% |
CHEMBL1994 | P08235 | Mineralocorticoid receptor | 87.67% | 100.00% |
CHEMBL1937 | Q92769 | Histone deacetylase 2 | 86.15% | 94.75% |
CHEMBL4145 | Q9UKV0 | Histone deacetylase 9 | 85.07% | 85.49% |
CHEMBL3137262 | O60341 | LSD1/CoREST complex | 84.85% | 97.09% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 84.02% | 94.45% |
CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 83.72% | 91.03% |
CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 83.46% | 97.25% |
CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 81.89% | 82.69% |
CHEMBL1977 | P11473 | Vitamin D receptor | 81.24% | 99.43% |
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.
Croton gratissimus var. gratissimus |
Guarea macrophylla |
PubChem | 15541537 |
LOTUS | LTS0050124 |
wikiData | Q104938117 |