(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(Z,4R)-4-hydroxy-2-tetradecyloctadec-2-enoxy]oxane-3,4,5-triol
| Internal ID | 5aeb300a-23c4-47b2-bb12-240ca56e91b2 |
| Taxonomy | Lipids and lipid-like molecules > Fatty Acyls > Fatty acyl glycosides > Fatty acyl glycosides of mono- and disaccharides |
| IUPAC Name | (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(Z,4R)-4-hydroxy-2-tetradecyloctadec-2-enoxy]oxane-3,4,5-triol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C38H74O7/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(31-44-38-37(43)36(42)35(41)34(30-39)45-38)29-33(40)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29,33-43H,3-28,30-31H2,1-2H3/b32-29-/t33-,34-,35-,36+,37-,38-/m1/s1 |
| InChI Key | RYXAMRKDUZLGND-RDKYCKHISA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C38H74O7 |
| Molecular Weight | 643.00 g/mol |
| Exact Mass | 642.54345470 g/mol |
| Topological Polar Surface Area (TPSA) | 120.00 Ų |
| XlogP | 12.40 |
| There are no found synonyms. |
![2D Structure of (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(Z,4R)-4-hydroxy-2-tetradecyloctadec-2-enoxy]oxane-3,4,5-triol](https://plantaedb.com/storage/docs/compounds/2023/11/2r3s4s5r6r-2-hydroxymethyl-6-z4r-4-hydroxy-2-tetradecyloctadec-2-enoxyoxane-345-triol.jpg "2D Structure of (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(Z,4R)-4-hydroxy-2-tetradecyloctadec-2-enoxy]oxane-3,4,5-triol")
| 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 |
|---|---|---|---|---|
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 97.84% | 99.17% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.08% | 96.09% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 95.91% | 97.29% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 95.05% | 92.86% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.79% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.62% | 91.11% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 92.83% | 92.08% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 89.84% | 94.73% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 89.08% | 93.56% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 88.36% | 100.00% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 87.59% | 91.81% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 87.07% | 85.94% |
| CHEMBL1293316 | Q9HBX9 | Relaxin receptor 1 | 86.74% | 82.50% |
| CHEMBL299 | P17252 | Protein kinase C alpha | 86.16% | 98.03% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 84.51% | 92.50% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 84.49% | 100.00% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 84.14% | 96.00% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 83.82% | 97.09% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 83.40% | 97.25% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 83.14% | 97.79% |
| CHEMBL2001 | Q9H244 | Purinergic receptor P2Y12 | 82.43% | 96.00% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 82.27% | 95.89% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 80.61% | 93.31% |
| CHEMBL218 | P21554 | Cannabinoid CB1 receptor | 80.48% | 96.61% |
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.
| There are no matching plants. |
| PubChem | 11541941 |
| LOTUS | LTS0134615 |
| wikiData | Q105248197 |