(3S)-3-[(4-hydroxyphenyl)methyl]-3,4-dihydro-2H-chromen-7-ol
| Internal ID | 6dc83a14-2e32-4c04-8f51-464573c24181 |
| Taxonomy | Phenylpropanoids and polyketides > Homoisoflavonoids > Homoisoflavans |
| IUPAC Name | (3S)-3-[(4-hydroxyphenyl)methyl]-3,4-dihydro-2H-chromen-7-ol |
| SMILES (Canonical) | C1C(COC2=C1C=CC(=C2)O)CC3=CC=C(C=C3)O |
| SMILES (Isomeric) | C1[C@@H](COC2=C1C=CC(=C2)O)CC3=CC=C(C=C3)O |
| InChI | InChI=1S/C16H16O3/c17-14-4-1-11(2-5-14)7-12-8-13-3-6-15(18)9-16(13)19-10-12/h1-6,9,12,17-18H,7-8,10H2/t12-/m0/s1 |
| InChI Key | GXMQROMLTBPBKV-LBPRGKRZSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C16H16O3 |
| Molecular Weight | 256.30 g/mol |
| Exact Mass | 256.109944368 g/mol |
| Topological Polar Surface Area (TPSA) | 49.70 Ų |
| XlogP | 3.40 |
| There are no found synonyms. |
![2D Structure of (3S)-3-[(4-hydroxyphenyl)methyl]-3,4-dihydro-2H-chromen-7-ol](https://plantaedb.com/storage/docs/compounds/2023/11/3s-3-4-hydroxyphenylmethyl-34-dihydro-2h-chromen-7-ol.jpg "2D Structure of (3S)-3-[(4-hydroxyphenyl)methyl]-3,4-dihydro-2H-chromen-7-ol")
| 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 | 97.64% | 91.11% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 94.56% | 95.89% |
| CHEMBL2581 | P07339 | Cathepsin D | 92.52% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.30% | 96.09% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 88.94% | 94.45% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 87.41% | 99.17% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 86.30% | 97.09% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 84.40% | 95.89% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 83.22% | 93.40% |
| CHEMBL5852 | Q96P65 | Pyroglutamylated RFamide peptide receptor | 82.39% | 85.00% |
| CHEMBL3891 | P07384 | Calpain 1 | 81.64% | 93.04% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 81.05% | 91.71% |
| CHEMBL236 | P41143 | Delta opioid receptor | 80.71% | 99.35% |
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.
| Anemarrhena asphodeloides |
| Dracaena cambodiana |
| Dracaena cinnabari |
| Dracaena draco |
| PubChem | 124350722 |
| LOTUS | LTS0209574 |
| wikiData | Q105023202 |