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Chemistry

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Also known as: 473-98-3, Betulinol, Betuline, Trochol, Betulol, Lup-20(29)-ene-3b,28-diol
Molecular Formula
C30H50O2
Molecular Weight
442.7  g/mol
InChI Key
FVWJYYTZTCVBKE-ROUWMTJPSA-N
FDA UNII
6W70HN7X7O

Betulin
betulin is a natural product found in Diospyros morrisiana, Diospyros eriantha, and other organisms with data available.
1 2D Structure

Betulin

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol
2.1.2 InChI
InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1
2.1.3 InChI Key
FVWJYYTZTCVBKE-ROUWMTJPSA-N
2.1.4 Canonical SMILES
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO
2.1.5 Isomeric SMILES
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)CO
2.2 Other Identifiers
2.2.1 UNII
6W70HN7X7O
2.3 Synonyms
2.3.1 MeSH Synonyms

1. (+)-betulin

2. (+)-betulin Diacetate

3. 3,28-di-o-acetylbetulin

4. 3,28-diacetoxy-betulin

5. Betulin Diacetate

6. Betuline

7. Betulinic Alcohol

8. Betulinol

9. Betulinol Biacetate

10. Betulinol Diacetate

11. Lup-20(29)-en-3 Alpha, 28,30-triol

12. Lup-20(29)-ene-3 Beta,28-diol

13. Lup-20(29)-ene-3,28-diol, 3,28-diacetate, (3 Beta)-

14. Lup-20(29)-ene-3alpha,28-diol

2.3.2 Depositor-Supplied Synonyms

1. 473-98-3

2. Betulinol

3. Betuline

4. Trochol

5. Betulol

6. Lup-20(29)-ene-3b,28-diol

7. Betulinic Alcohol

8. Lup-20(29)-ene-3beta,28-diol

9. (+)-betulin

10. Lup-20(30)-ene-3beta,28-diol

11. Nsc 4644

12. Nsc-4644

13. 6w70hn7x7o

14. Chebi:3086

15. (1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1h-cyclopenta[a]chrysen-9-ol

16. (3beta)-lup-20(29)-ene-3,28-diol

17. Lup-20(29)-ene-3,28-diol, (3.beta.)-

18. (1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol

19. (1r,2r,5s,8r,9r,10r,13r,14r,17s,19r)-5-(hydroxymethyl)-1,2,14,18,18-pentamethyl-8-(prop-1-en-2-yl)pentacyclo[11.8.0.0^{2,10}.0^{5,9}.0^{14,19}]henicosan-17-ol

20. (1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br)-3a-(hydroxymethyl)-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol

21. Sr-05000002167

22. Einecs 207-475-5

23. Lup-20(29)-ene-3 Beta,28-diol

24. Nsc4644

25. Unii-6w70hn7x7o

26. Ai3-62999

27. Nsc692218

28. Lup-20(29)-ene-3,28-diol, (3beta)-

29. Lup-20(29)-ene-3.beta.,28-diol

30. Lup-20(30)-ene-3.beta.,28-diol

31. Betulinol (obsol.)

32. Mfcd00016802

33. Betulin, 23

34. Oristract Btl

35. Cp Betulin

36. Betulin [inci]

37. Betulin, >=98%

38. Betulin [mi]

39. Prestwick3_000990

40. Betulinol (obsol Pound(c)

41. Betulin, Analytical Standard

42. Bspbio_001059

43. Chembl23236

44. Schembl131739

45. Bpbio1_001165

46. Megxp0_001726

47. Acon1_000091

48. Bdbm23207

49. Dtxsid101019934

50. Hms2098e21

51. Ex-a3354

52. Hy-n0083

53. Zinc3978650

54. S4754

55. Lup-20(29)-ene-3 ,28-diol

56. Akos005267212

57. Lup-20(29)-ene-3beta ,28-diol

58. Lup-20(30)-ene-3beta ,28-diol

59. Ccg-208619

60. Cs-6156

61. Gs-3254

62. Lmpr0106140005

63. Nsc-692218

64. Ncgc00168803-01

65. Ncgc00168803-02

66. Ncgc00168803-04

67. Ab00513988

68. B0803

69. N1290

70. (3.beta.)-lup-20(29)-ene-3,28-diol

71. C08618

72. Lup-20(29)-ene-3,28-diol, (3beta )-

73. 473b983

74. A827211

75. Q419726

76. Q-100501

77. Sr-05000002167-2

78. Sr-05000002167-3

79. Brd-k64874225-001-01-3

80. Ncgc00168803-04_c30h50o2_lup-20(29)-ene-3,28-diol, (3beta)-

81. (1r,3as,5ar,5br,7ar,9s,11ar,11br,13ar,13br)-3 A-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1h-cyclopenta[a]chrysen-9-ol

82. (3as,5br,9s,11ar)-3a-(hydroxymethyl)-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol;betulin

83. 7372-31-8

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 442.7 g/mol
Molecular Formula C30H50O2
XLogP38.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass442.381080833 g/mol
Monoisotopic Mass442.381080833 g/mol
Topological Polar Surface Area40.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity786
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

REF. STANDARDS & IMPURITIES

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Looking for 473-98-3 / Betulin API manufacturers, exporters & distributors?

Betulin manufacturers, exporters & distributors 1

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PharmaCompass offers a list of Betulin API manufacturers, exporters & distributors, which can be sorted by GMP, USDMF, JDMF, KDMF, CEP (COS), WC, Price,and more, enabling you to easily find the right Betulin manufacturer or Betulin supplier for your needs.

Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred Betulin manufacturer or Betulin supplier.

PharmaCompass also assists you with knowing the Betulin API Price utilized in the formulation of products. Betulin API Price is not always fixed or binding as the Betulin Price is obtained through a variety of data sources. The Betulin Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

Betulin

Synonyms

473-98-3, Betulinol, Betuline, Trochol, Betulol, Lup-20(29)-ene-3b,28-diol

Cas Number

473-98-3

Unique Ingredient Identifier (UNII)

6W70HN7X7O

About Betulin

betulin is a natural product found in Diospyros morrisiana, Diospyros eriantha, and other organisms with data available.

Betulin Manufacturers

A Betulin manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Betulin, including repackagers and relabelers. The FDA regulates Betulin manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Betulin API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Betulin Suppliers

A Betulin supplier is an individual or a company that provides Betulin active pharmaceutical ingredient (API) or Betulin finished formulations upon request. The Betulin suppliers may include Betulin API manufacturers, exporters, distributors and traders.

Betulin GMP

Betulin Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Betulin GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Betulin GMP manufacturer or Betulin GMP API supplier for your needs.

Betulin CoA

A Betulin CoA (Certificate of Analysis) is a formal document that attests to Betulin's compliance with Betulin specifications and serves as a tool for batch-level quality control.

Betulin CoA mostly includes findings from lab analyses of a specific batch. For each Betulin CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Betulin may be tested according to a variety of international standards, such as European Pharmacopoeia (Betulin EP), Betulin JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Betulin USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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