loader
Please Wait
Applying Filters...

Pluviaendo Visuals Pluviaendo Visuals

X

Technical details about Etiproston, learn more about the structure, uses, toxicity, action, side effects and more

Client Email Product
Menu
2D Structure
1. Also known as: 59619-81-7, Etiprostone, Etiproston [inn], Prostavet, Tcu22w0apy, (z)-7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e)-2-[2-(phenoxymethyl)-1,3-dioxolan-2-yl]ethenyl]cyclopentyl]hept-5-enoic acid
Molecular Formula
C24H32O7
Molecular Weight
432.5  g/mol
InChI Key
BPALXSWPHQNCAA-RLJNYRALSA-N
FDA UNII
TCU22W0APY

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E)-2-[2-(phenoxymethyl)-1,3-dioxolan-2-yl]ethenyl]cyclopentyl]hept-5-enoic acid
2.1.2 InChI
InChI=1S/C24H32O7/c25-21-16-22(26)20(19(21)10-6-1-2-7-11-23(27)28)12-13-24(30-14-15-31-24)17-29-18-8-4-3-5-9-18/h1,3-6,8-9,12-13,19-22,25-26H,2,7,10-11,14-17H2,(H,27,28)/b6-1-,13-12+/t19-,20-,21+,22-/m1/s1
2.1.3 InChI Key
BPALXSWPHQNCAA-RLJNYRALSA-N
2.1.4 Canonical SMILES
C1COC(O1)(COC2=CC=CC=C2)C=CC3C(CC(C3CC=CCCCC(=O)O)O)O
2.1.5 Isomeric SMILES
C1COC(O1)(COC2=CC=CC=C2)/C=C/[C@H]3[C@@H](C[C@@H]([C@@H]3C/C=C\CCCC(=O)O)O)O
2.2 Other Identifiers
2.2.1 UNII
TCU22W0APY
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Etiproston Tromethamine

2.3.2 Depositor-Supplied Synonyms

1. 59619-81-7

2. Etiprostone

3. Etiproston [inn]

4. Prostavet

5. Tcu22w0apy

6. (z)-7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e)-2-[2-(phenoxymethyl)-1,3-dioxolan-2-yl]ethenyl]cyclopentyl]hept-5-enoic Acid

7. Etiproston (inn)

8. (z)-7-((1r,2r,3r,5s)-3,5-dihydroxy-2-((e)-2-(2-(phenoxymethyl)-1,3-dioxolan-2-yl)vinyl)cyclopentyl)-5-heptenoic Acid

9. Etiprostonum

10. Etiprostone [inn-french]

11. Unii-tcu22w0apy

12. Etiprostonum [inn-latin]

13. Brn 1274276

14. Etiproston [mi]

15. Prostavet [veterinary] (tn)

16. Chembl2104285

17. Schembl11602088

18. Dtxsid501024232

19. Zinc30691625

20. 15-deoxy-15,15-ethylenedioxy-16-phenoxy-17,18,19,20-tetranor-pgf2-alpha

21. 15-deoxy-15,15-ethylenedioxy-16-phenoxy-17,18,19,20-tetranor-prostaglandin F2-alpha

22. D07932

23. 619e817

24. Q27289904

25. 15-deoxy-15, 15-ethylenedioxy-16-phenoxy-omega-tetranor Pgf-2alpha

26. 5-heptenoic Acid, 7-(3,5-dihydroxy-2-(2-(2-(phenoxymethyl)-1,3-dioxolan-2-yl)ethenyl)cyclopentyl)-, (1r-(1-alpha(z),2-beta(e),3-alpha,5-alpha))-

2.4 Create Date
2005-12-16
3 Chemical and Physical Properties
Molecular Weight 432.5 g/mol
Molecular Formula C24H32O7
XLogP32.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Exact Mass432.21480336 g/mol
Monoisotopic Mass432.21480336 g/mol
Topological Polar Surface Area105 Ų
Heavy Atom Count31
Formal Charge0
Complexity605
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Post Enquiry
POST ENQUIRY