+Open data
-Basic information
Entry | Database: PDB chemical components / ID: YSS |
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Name | Name: Synonyms: (5Z,13E,15R,16E)-9alpha,15-dihydroxy-15-methyl-11-oxo-12alpha-prosta-5,13,16-trien-1-oic acid |
-Chemical information
Composition | Formula: C21H34O5 / Number of atoms: 60 / Formula weight: 366.492 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: YSS / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7M8W | ||||
History |
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External links | UniChem / ChemSpider / ChEBI / GtoPharmacology / LipidMaps / Nikkaji / PubChem / PubChem_TPharma / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | (OpenEye OEToolkits 2.0.7 | (~{ | |
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-PDB entries
Showing all 1 items
PDB-7m8w:
XFEL crystal structure of the prostaglandin D2 receptor CRTH2 in complex with 15R-methyl-PGD2