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Chemistry

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Also known as: Helixin, Kalopanaxsaponin a, Hederoside c, Tauroside e, 27013-91-8, Koronaroside a
Molecular Formula
C41H66O12
Molecular Weight
751.0  g/mol
InChI Key
KEOITPILCOILGM-LLJOFIFVSA-N
FDA UNII
4H15F0GLV2

Alpha-Hederin
-hederin is a natural product found in Lonicera japonica, Hedera caucasigena, and other organisms with data available.
1 2D Structure

Alpha-Hederin

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-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/C41H66O12/c1-21-28(44)30(46)31(47)33(51-21)53-32-29(45)24(43)19-50-34(32)52-27-11-12-37(4)25(38(27,5)20-42)10-13-40(7)26(37)9-8-22-23-18-36(2,3)14-16-41(23,35(48)49)17-15-39(22,40)6/h8,21,23-34,42-47H,9-20H2,1-7H3,(H,48,49)/t21-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33-,34-,37-,38-,39+,40+,41-/m0/s1
2.1.3 InChI Key
KEOITPILCOILGM-LLJOFIFVSA-N
2.1.4 Canonical SMILES
CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O)O
2.1.5 Isomeric SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2O[C@H]3CC[C@]4([C@H]([C@]3(C)CO)CC[C@@]5([C@@H]4CC=C6[C@]5(CC[C@@]7([C@H]6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O)O
2.2 Other Identifiers
2.2.1 UNII
4H15F0GLV2
2.3 Synonyms
2.3.1 MeSH Synonyms

1. .alpha.-hederin

2. Pulsatilla Saponin A

3. Rha-ara-3beta-hederagenin

2.3.2 Depositor-Supplied Synonyms

1. Helixin

2. Kalopanaxsaponin A

3. Hederoside C

4. Tauroside E

5. 27013-91-8

6. Koronaroside A

7. Prosapogenin Cp3b

8. Glycoside L-e1

9. Akeboside Stc

10. Sapindoside A

11. Nepalin 2

12. Pulsatilla Saponin A

13. Akebia Saponin Pd

14. Kizuta Saponin K6

15. Alpha-hederine

16. .alpha.-hederin

17. 4h15f0glv2

18. Chebi:69370

19. (4as,6ar,6as,6br,8ar,9r,10s,12ar,14bs)-10-[(2s,3r,4s,5s)-4,5-dihydroxy-3-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-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

20. Helixin (van)

21. Alpha-hederin Hydrate

22. Hederin

23. Alpha-hederine [french]

24. (4as,6as,6br,8ar,9r,10s,12ar,12br,14bs)-10-(((2s,3r,4s,5s)-4,5-dihydroxy-3-(((2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyltetrahydro-2h-pyran-2-yl)oxy)tetrahydro-2h-pyran-2-yl)oxy)-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

25. Einecs 248-166-5

26. Nsc 106553

27. Brn 0076156

28. Unii-4h15f0glv2

29. Nsc106553

30. Akebiasaponin Pd

31. Kizutasaponin K6

32. Nsc-106553

33. Alfa-hederina

34. Rha-ara-3beta-hederagenin

35. 4-17-00-02560 (beilstein Handbook Reference)

36. .alpha.-hederin [mi]

37. Chembl447565

38. Schembl3007691

39. Alfa-hederina [who-dd]

40. Dtxsid80909168

41. (4as,6ar,6as,6br,8ar,9r,10s,12ar,14bs)-10-[(2s,3r,4s,5s)-4,5-dihydroxy-3-[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-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

42. Hy-n0255

43. Mfcd26960932

44. S3914

45. Zinc95098996

46. Akos032961986

47. Ccg-270437

48. Cs-5690

49. (4alpha)-3beta-((2-o-(6-deoxy-alpha-l-mannopyranosyl)-alpha-l-arabinopyranosyl)oxy)-23-hydroxyolean-12-en-28-oic Acid

50. Ac-33961

51. Olean-12-en-28-oic Acid, 3-((2-o-(6-deoxy-alpha-l-mannopyranosyl)-alpha-l-arabinopyranosyl)oxy)-23-hydroxy-, (3-beta,4-alpha)-

52. N2051

53. C08954

54. Q25105925

55. 3-o-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-arabinopyranosyl Hederagenin

56. (4.alpha.)-3.beta.-((2-o-(6-deoxy-.alpha.-l-mannopyranosyl)-.alpha.- L-arabinopyranosyl)oxy)-23-hydroxyolean-12-en-28-oic Acid

57. (4alpha)-3beta-((2-o-(6-deoxy-alpha-l-mannopyranosyl)-alpha- L-arabinopyranosyl)oxy)-23-hydroxyolean-12-en-28-oic Acid

58. (4as,6as,6br,8ar,9r,10s,12ar,12br,14bs)-10-(((2s,3r,4s,5s)-4,5-dihydroxy-3-(((2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyltetrahydro-2h-pyran-2-yl)oxy)tetrahydro-2h-pyran-2-yl)oxy)-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-carboxylicacid

59. 3beta-{[2-o-(6-deoxy-alpha-l-mannopyranosyl)-alpha-l-arabinopyranosyl]oxy}-23-hydroxyolean-12-en-28-oic Acid

60. Olean-12-en-28-oic Acid, 3-((2-o-(6-deoxy-alpha-l- Mannopyranosyl)-alpha-l-arabinopyranosyl)oxy)-23-hydroxy-, (3-beta,4-alpha)-

61. Olean-12-en-28-oic Acid, 3-[[2-o-(6-deoxy-.alpha.-l-mannopyranosyl)-.alpha.-l-arabinopyranosyl]oxy]-23-hydroxy-, (3.beta., 4.alpha.)

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 751.0 g/mol
Molecular Formula C41H66O12
XLogP33.6
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Exact Mass750.45542754 g/mol
Monoisotopic Mass750.45542754 g/mol
Topological Polar Surface Area196 Ų
Heavy Atom Count53
Formal Charge0
Complexity1440
Isotope Atom Count0
Defined Atom Stereocenter Count18
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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Looking for 27013-91-8 / Alpha-Hederin API manufacturers, exporters & distributors?

Alpha-Hederin manufacturers, exporters & distributors 1

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PharmaCompass offers a list of Alpha-Hederin 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 Alpha-Hederin manufacturer or Alpha-Hederin supplier for your needs.

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

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

API | Excipient name

Alpha-Hederin

Synonyms

Helixin, Kalopanaxsaponin a, Hederoside c, Tauroside e, 27013-91-8, Koronaroside a

Cas Number

27013-91-8

Unique Ingredient Identifier (UNII)

4H15F0GLV2

About Alpha-Hederin

-hederin is a natural product found in Lonicera japonica, Hedera caucasigena, and other organisms with data available.

Alpha-Hederin Manufacturers

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

Alpha-Hederin Suppliers

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

Alpha-Hederin GMP

Alpha-Hederin 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 Alpha-Hederin 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 Alpha-Hederin GMP manufacturer or Alpha-Hederin GMP API supplier for your needs.

Alpha-Hederin CoA

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

Alpha-Hederin CoA mostly includes findings from lab analyses of a specific batch. For each Alpha-Hederin 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.

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