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Name | thromboxane B2 |
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Molecular formula | C20H34O6 |
IUPAC name | (Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoic acid |
Molecular weight | 370.486 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 4 |
XlogP | 2.4 |
Synonyms | (5Z,13E,15S)-9alpha,11,15-trihydroxythromboxa-5,13-dien-1-oic acid 8-(1-Hydroxy-3-oxopropyl)-9,12-dihydroxy-5,10-heptadecadienoic Acid Hemiacetal CHEMBL1552426 SMP1_000294 (5Z,9|A,13E,15S)9,11,15-Trihydroxythromboxa-5,13-dien-1-oic Acid [ Show all ] |
Inchi Key | XNRNNGPBEPRNAR-JQBLCGNGSA-N |
Inchi ID | InChI=1S/C20H34O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h4,7,12-13,15-18,20-22,25H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/b7-4-,13-12+/t15-,16-,17-,18+,20?/m0/s1 |
PubChem CID | 5283137 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 82210 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
396591 | Prostaglandin D2 receptor | Q9R261 | Ptgdr | Rattus norvegicus (Rat) | 357 |
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