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- ChemComp-7WT: Z-7-[(1R,2R,3R,5S)-3,5-bis(oxidanyl)-2-[(3R)-3-oxidanyl-5-phenyl-... -

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Basic information

EntryDatabase: PDB chemical components / ID: 7WT
NameName: Z-7-[(1R,2R,3R,5S)-3,5-bis(oxidanyl)-2-[(3R)-3-oxidanyl-5-phenyl-pentyl]cyclopentyl]hept-5-enoic acid
Synonyms: 7-[3,5-Dihydroxy-2-(3-hydroxy-5-phenylpentyl)cyclopentyl]hept-5-enoic acid

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Chemical information

Composition
Formula: C23H34O5 / Number of atoms: 62 / Formula weight: 390.513 / Formal charge: 0
Others

8iq6

Type: non-polymer / PDB classification: HETAIN / Three letter code: 7WT / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8IQ6
History
Create componentMar 13, 2023
Other modificationJun 9, 2023
Initial releaseJul 12, 2023
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

CACTVS 3.385O[CH](CC[CH]1[CH](O)C[CH](O)[CH]1CC=CCCCC(O)=O)CCc2ccccc2
OpenEye OEToolkits 2.0.7c1ccc(cc1)CCC(CCC2C(CC(C2CC=CCCCC(=O)O)O)O)O

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SMILES CANONICAL

CACTVS 3.385O[C@H](CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O)CCc2ccccc2
OpenEye OEToolkits 2.0.7c1ccc(cc1)CC[C@@H](CC[C@H]2[C@@H](C[C@@H]([C@@H]2C/C=C\CCCC(=O)O)O)O)O

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InChI

InChI 1.06InChI=1S/C23H34O5/c24-18(13-12-17-8-4-3-5-9-17)14-15-20-19(21(25)16-22(20)26)10-6-1-2-7-11-23(27)28/h1,3-6,8-9,18-22,24-26H,2,7,10-16H2,(H,27,28)/b6-1-/t18-,19+,20+,21-,22+/m0/s1

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InChIKey

InChI 1.06HNPFPERDNWXAGS-NFVOFSAMSA-N

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PDB entries

Showing all 3 items

PDB-8iq6:
Cryo-EM structure of Latanoprost-bound prostaglandin-F2-alpha receptor-miniGq-Nb35 complex

PDB-8iul:
Cryo-EM structure of the latanoprost-bound human PTGFR-Gq complex

PDB-8xjm:
Latanoprost acid bound Prostaglandin F2-alpha receptor-Gq Protein Complex

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