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85280-90-6,MFCD00216046
Catalog No.:AA004UW5

85280-90-6 | Prosta-5,13-dien-1-oicacid, 9,15-dihydroxy-15-methyl-11-oxo-, (5Z,9a,13E,15S)-

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  • Technical Information
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Technical Information
Catalog Number:
AA004UW5
Chemical Name:
Prosta-5,13-dien-1-oicacid, 9,15-dihydroxy-15-methyl-11-oxo-, (5Z,9a,13E,15S)-
CAS Number:
85280-90-6
Molecular Formula:
C21H34O5
Molecular Weight:
366.4917
MDL Number:
MFCD00216046
SMILES:
CCCCC[C@@](/C=C/[C@H]1C(=O)C[C@@H]([C@@H]1C/C=C\CCCC(=O)O)O)(O)C
Properties
Computed Properties
 
Complexity:
511  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
2  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
12  
XLogP3:
2.8  

Literature

Title: 15R-methyl-prostaglandin D2 is a potent and selective CRTH2/DP2 receptor agonist in human eosinophils.

Journal: The Journal of pharmacology and experimental therapeutics 20030101

Title: Molecular pharmacology of the human prostaglandin D2 receptor, CRTH2.

Journal: British journal of pharmacology 20021201

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SDS
Tags:85280-90-6 Molecular Formula|85280-90-6 MDL|85280-90-6 SMILES|85280-90-6 Prosta-5,13-dien-1-oicacid, 9,15-dihydroxy-15-methyl-11-oxo-, (5Z,9a,13E,15S)-