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Chemistry

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Also known as: Cycloartenyl ferulate, Gamma oryzanol, Oliver, 11042-64-1, Gammariza, Gamma-orizanol
Molecular Formula
C40H58O4
Molecular Weight
602.9  g/mol
InChI Key
FODTZLFLDFKIQH-FSVGXZBPSA-N
FDA UNII
3PQR2YON9T

Gamma Oryzanol
oryzanol a is a natural product found in Krameria bicolor, Krameria grayi, and other organisms with data available.
1 2D Structure

Gamma Oryzanol

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
2.1.2 InChI
InChI=1S/C40H58O4/c1-26(2)10-9-11-27(3)29-18-20-38(7)33-16-15-32-36(4,5)34(19-21-39(32)25-40(33,39)23-22-37(29,38)6)44-35(42)17-13-28-12-14-30(41)31(24-28)43-8/h10,12-14,17,24,27,29,32-34,41H,9,11,15-16,18-23,25H2,1-8H3/b17-13+/t27-,29-,32+,33+,34+,37-,38+,39-,40+/m1/s1
2.1.3 InChI Key
FODTZLFLDFKIQH-FSVGXZBPSA-N
2.1.4 Canonical SMILES
CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)OC(=O)C=CC6=CC(=C(C=C6)O)OC)C)C
2.1.5 Isomeric SMILES
C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)CC[C@@H](C5(C)C)OC(=O)/C=C/C6=CC(=C(C=C6)O)OC)C)C
2.2 Other Identifiers
2.2.1 UNII
3PQR2YON9T
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Cycloartenyl Ferulate

2. Gamma Oryzanol

3. Oliver

4. 11042-64-1

5. Gammariza

6. Gamma-orizanol

7. Hi-z

8. Cycloartenol Trans-ferulate

9. Cycloartenol Ferulate

10. Gamma Oryzanol [jan]

11. 3-o-ferulylcycloartenol

12. 3pqr2yon9t

13. Ferulic Acid Cycloartenol Ester

14. Oryzanol A

15. Gamma Oryzanol (jan)

16. Dsstox_cid_1084

17. 21238-33-5

18. Dsstox_rid_75932

19. Dsstox_gsid_21084

20. Cas-11042-64-1

21. Unii-sst9xcl51m

22. Cycloartenol Ferulic Acid Ester

23. Ccris 4251

24. Y-oryzanol

25. Gamma -oryzanol

26. Ncgc00181756-01

27. 9,19-cyclolanost-24-en-3-ol, 3-((2e)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate), (3.beta.)-

28. 9,19-cyclolanost-24-en-3-ol, 3-[(2e)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate], (3.beta.)-

29. Gamma-oryzanol (tn)

30. Oryzanol A [mi]

31. Unii-3pqr2yon9t

32. Sst9xcl51m

33. Hi-z (tn)

34. Cycloartenol, Trans-ferulate

35. Schembl718726

36. (3beta)-9,19-cyclolanost-24-en-3-yl 4-hydroxy-3-methoxycinnamate

37. Chembl388595

38. Chebi:32345

39. Cycloartenyl Ferulate [inci]

40. Einecs 244-285-1

41. Tox21_112482

42. Bdbm50483936

43. Mfcd00867548

44. S3957

45. Zinc28646872

46. Akos016339566

47. Tox21_112482_1

48. Ccg-270201

49. Oz

50. Hy-125938

51. Cs-0103198

52. D01221

53. E88692

54. J-002421

55. Q27257875

56. 9,19-cyclo-9beta-lanost-24-en-3beta-ol 4-hydroxy-3-methoxycinamate

57. 9,19-cyclo-9.beta.-lanost-24-en-3.beta.-ol 4-hydroxy-3-methoxycinamate

58. 9,19-cyclo-9.beta.-lanost-24-en-3.beta.-ol, 4-hydroxy-3-methoxycinnamate

59. [(1s,3r,6s,8r,11s,12s,15r,16r)-7,7,12,16-tetramethyl-15-[(2r)-6-methylhept-5-en-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

60. 286011-27-6

61. 9,19-cyclolanost-24-en-3-ol, (2e)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, (3.beta.)-

62. 9,19-cyclolanost-24-en-3-ol, 3-(4-hydroxy-3-methoxyphenyl)-2-propenoate, (3.beta.)-

63. Cinnamic Acid, 4-hydroxy-3-methoxy-, 9,19-cyclo-9.beta.-lanost-24-en-3.beta.-yl Ester

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 602.9 g/mol
Molecular Formula C40H58O4
XLogP312.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass602.43351033 g/mol
Monoisotopic Mass602.43351033 g/mol
Topological Polar Surface Area55.8 Ų
Heavy Atom Count44
Formal Charge0
Complexity1150
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

API Reference Price

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30-Sep-2023
20-Oct-2023
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