Also known as: 1143-70-0, 3,8-dihydroxy-6h-benzo[c]chromen-6-one, 3,8-dihydroxyurolithin, 3,8-dihydroxybenzo[c]chromen-6-one, 3,8-dihydroxy-6h-dibenzo(b,d)pyran-6-one, 6h-dibenzo[b,d]pyran-6-one, 3,8-dihydroxy-

Molecular Formula

C₁₃H₈O₄

Molecular Weight

228.20 g/mol

InChI Key

RIUPLDUFZCXCHM-UHFFFAOYSA-N

FDA UNII

ILJ8NEF6DT

urolithin A is a natural product found in Punica granatum and Trogopterus xanthipes with data available.

1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3,8-dihydroxybenzo[c]chromen-6-one

2.1.2 InChI

InChI=1S/C13H8O4/c14-7-1-3-9-10-4-2-8(15)6-12(10)17-13(16)11(9)5-7/h1-6,14-15H

2.1.3 InChI Key

RIUPLDUFZCXCHM-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC2=C(C=C1O)C(=O)OC3=C2C=CC(=C3)O

2.2 Other Identifiers

2.2.1 UNII

ILJ8NEF6DT

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 3,8-dihydroxy-6h-dibenzo(b,d)pyran-6-one

2.3.2 Depositor-Supplied Synonyms

1. 1143-70-0

2. 3,8-dihydroxy-6h-benzo[c]chromen-6-one

3. 3,8-dihydroxyurolithin

4. 3,8-dihydroxybenzo[c]chromen-6-one

5. 3,8-dihydroxy-6h-dibenzo(b,d)pyran-6-one

6. 6h-dibenzo[b,d]pyran-6-one, 3,8-dihydroxy-

7. 3,8-hydroxydibenzo-alpha-pyrone

8. Ilj8nef6dt

9. 3,8-dihydroxy-6h-dibenzo[b,d]pyran-6-one

10. Mfcd20275235

11. 6h-dibenzo(b,d)pyran-6-one, 3,8-dihydroxy-

12. Uro-a

13. 3,8-dihydroxybenzo(c)chromen-6-one

14. Urolithin-a

15. Unii-ilj8nef6dt

16. 3,8-dihydroxy-urolithin

17. Schembl803408

18. Chembl1836264

19. Dtxsid40150694

20. Chebi:168442

21. Urolithin A, >=97% (hplc)

22. Ex-a4345

23. S5312

24. Zinc13484727

25. Akos028108778

26. Ccg-266776

27. Cs-6305

28. Db15464

29. Ac-31959

30. Ds-19328

31. Sy070232

32. Db-122496

33. Hy-100599

34. Ft-0778244

35. Y10574

36. A901528

37. J-003086

38. Q15634120

39. 2-biphenylcarboxylic Acid, 2',4,4'-trihydroxy-, Delta-lactone

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₈O₄
Molecular Weight	228.20 g/mol
XLogP3	2.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	228.04225873 g/mol
Monoisotopic Mass	228.04225873 g/mol
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	317
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

Urolithin A

Urolithin A

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