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Chemistry

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Also known as: 465-99-6, Caulosapogenin, Hederagenol, Astrantiagenin e, Hederagenic acid, (4as,6ar,6as,6br,8ar,9r,10s,12ar,14bs)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Molecular Formula
C30H48O4
Molecular Weight
472.7  g/mol
InChI Key
PGOYMURMZNDHNS-MYPRUECHSA-N
FDA UNII
RQF57J8212

Hederagenin
hederagenin is a natural product found in Zygophyllum obliquum, Sapindus emarginatus, and other organisms with data available.
1 2D Structure

Hederagenin

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
2.1.2 InChI
InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1
2.1.3 InChI Key
PGOYMURMZNDHNS-MYPRUECHSA-N
2.1.4 Canonical SMILES
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C
2.1.5 Isomeric SMILES
C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)CO)O
2.2 Other Identifiers
2.2.1 UNII
RQF57J8212
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Cyclocaric Acid A

2.3.2 Depositor-Supplied Synonyms

1. 465-99-6

2. Caulosapogenin

3. Hederagenol

4. Astrantiagenin E

5. Hederagenic Acid

6. (4as,6ar,6as,6br,8ar,9r,10s,12ar,14bs)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic Acid

7. Chebi:69579

8. 4-epi-hederagenin

9. Rqf57j8212

10. Nsc-24954

11. Olean-12-en-28-oic Acid, 3,23-dihydroxy-, (3b,4a)-

12. (3beta)-3,23-dihydroxyolean-12-en-28-oic Acid

13. (3-beta,4-alpha)-3,23-dihydroxyolean-12-en-28-oic Acid

14. Hederagenine

15. Nsc 24954

16. (3beta,4alpha)-3,23-dihydroxyolean-12-en-28-oic Acid

17. Einecs 207-369-9

18. Unii-rqf57j8212

19. Hederagenin,(s)

20. Hederagenin [mi]

21. Olean-12-en-28-oic Acid, 3.beta.,23-dihydroxy-

22. Olean-12-en-28-oic Acid, 3beta,23-dihydroxy-

23. Hederagenin, (+)-

24. Schembl359809

25. Olean-12-en-28-oic Acid, 3,23-dihydroxy-, (3.beta.,4.alpha.)-

26. Chembl486400

27. Hederagenin, >=97% (hplc)

28. Dtxsid301029412

29. Hy-n0256

30. Nsc24954

31. Olean-12-en-28-oic Acid, 3,23-dihydroxy-, (3-beta,4-alpha)-

32. Olean-12-en-28-oic Acid, 3,23-dihydroxy-, (3beta,4alpha)-

33. Zinc3946009

34. Bdbm50442880

35. Mfcd00017385

36. S3899

37. Akos016036289

38. Ccg-269472

39. Cs-5454

40. As-68383

41. Olean-12-en-28-oic Acid,23-dihydroxy-

42. H1645

43. N1306

44. 3ss,4a-3,23-dihydroxyolean-12-en-28-oicacid

45. 465h996

46. A872247

47. Olean-12-en-28-oic Acid, 3-beta,23-dihydroxy-

48. Q-100493

49. Q5697238

50. 3beta,4alpha-3,23-dihydroxyolean-12-en-28-oic Acid

51. Olean-12-en-28-oic Acid,23-dihydroxy-, (3.beta.,4.alpha.)-

52. (4as,6as,6br,8ar,9r,10s,12ar,12br,14bs)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic Acid

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 472.7 g/mol
Molecular Formula C30H48O4
XLogP36.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass472.35526001 g/mol
Monoisotopic Mass472.35526001 g/mol
Topological Polar Surface Area77.8 Ų
Heavy Atom Count34
Formal Charge0
Complexity908
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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Hederagenin manufacturers, exporters & distributors 1

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PharmaCompass offers a list of Hederagenin 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 Hederagenin manufacturer or Hederagenin supplier for your needs.

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

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

API | Excipient name

Hederagenin

Synonyms

465-99-6, Caulosapogenin, Hederagenol, Astrantiagenin e, Hederagenic acid, (4as,6ar,6as,6br,8ar,9r,10s,12ar,14bs)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Cas Number

465-99-6

Unique Ingredient Identifier (UNII)

RQF57J8212

About Hederagenin

hederagenin is a natural product found in Zygophyllum obliquum, Sapindus emarginatus, and other organisms with data available.

Hederagenin Manufacturers

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

Hederagenin Suppliers

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

Hederagenin GMP

Hederagenin 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 Hederagenin 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 Hederagenin GMP manufacturer or Hederagenin GMP API supplier for your needs.

Hederagenin CoA

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

Hederagenin CoA mostly includes findings from lab analyses of a specific batch. For each Hederagenin 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.

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