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Chemistry

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Also known as: 3569-10-6, (-)-valerenic acid, Valerenicacid, Chebi:9921, 34ndb285pm, (2e)-3-[(4s,7r,7ar)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1h-inden-4-yl]-2-methylacrylic acid
Molecular Formula
C15H22O2
Molecular Weight
234.33  g/mol
InChI Key
FEBNTWHYQKGEIQ-SUKRRCERSA-N
FDA UNII
34NDB285PM

Valerenic Acid
(2E)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid is a natural product found in Valeriana officinalis and Homo sapiens with data available.
1 2D Structure

Valerenic Acid

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(E)-3-[(4S,7R,7aR)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid
2.1.2 InChI
InChI=1S/C15H22O2/c1-9-4-6-12(8-11(3)15(16)17)14-10(2)5-7-13(9)14/h8-9,12-13H,4-7H2,1-3H3,(H,16,17)/b11-8+/t9-,12+,13-/m1/s1
2.1.3 InChI Key
FEBNTWHYQKGEIQ-SUKRRCERSA-N
2.1.4 Canonical SMILES
CC1CCC(C2=C(CCC12)C)C=C(C)C(=O)O
2.1.5 Isomeric SMILES
C[C@@H]1CC[C@H](C2=C(CC[C@H]12)C)/C=C(\C)/C(=O)O
2.2 Other Identifiers
2.2.1 UNII
34NDB285PM
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 3569-10-6

2. (-)-valerenic Acid

3. Valerenicacid

4. Chebi:9921

5. 34ndb285pm

6. (2e)-3-[(4s,7r,7ar)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1h-inden-4-yl]-2-methylacrylic Acid

7. (2e)-3-[(4s,7r,7ar)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1h-inden-4-yl]-2-methylprop-2-enoic Acid

8. (2e)-3-[(4s,7r,7ar)-2,4,5,6,7,7a-hexadydro-3,7-dimethyl-1h-inden-4-yl]-2-methyl-2-propenoic Acid

9. (2e)-3-((4s,7r,7ar)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1h-inden-4-yl)-2-methylacrylic Acid

10. Valerian Dry Extract

11. Dsstox_cid_14089

12. Dsstox_rid_79112

13. Unii-34ndb285pm

14. Dsstox_gsid_34089

15. Schembl403082

16. Schembl403083

17. Chembl1545045

18. Dtxsid8034089

19. Valerenic Acid [usp-rs]

20. Valerenic Acid, Analytical Standard

21. (e)-3-((4s,7r,7ar)-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1h-inden-4-yl)-2-methylacrylic Acid

22. Tox21_200313

23. Bdbm50341378

24. Mfcd00075694

25. Zinc15657741

26. Akos024457400

27. Ncgc00091912-01

28. Ncgc00091912-02

29. Ncgc00257867-01

30. 2-propenoic Acid, 3-(2,4,5,6,7,7a-hexahydro-3,7-dimethyl-1h-inden-4-yl)-2-methyl-, (4s-(4alpha(e),7beta,7aalpha))-

31. Cas-3569-10-6

32. Hy-103524

33. B7254

34. Cs-0028025

35. C09743

36. 569v106

37. Valerenic Acid (constituent Of Valerian) [dsc]

38. Valerenic Acid, Primary Pharmaceutical Reference Standard

39. Valerenic Acid, United States Pharmacopeia (usp) Reference Standard

40. Valerian Standardised Dry Extract, European Pharmacopoeia (ep) Reference Standard

2.4 Create Date
2006-04-28
3 Chemical and Physical Properties
Molecular Weight 234.33 g/mol
Molecular Formula C15H22O2
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass234.161979940 g/mol
Monoisotopic Mass234.161979940 g/mol
Topological Polar Surface Area37.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity390
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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ABOUT THIS PAGE

Valerenic Acid Manufacturers

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

click here to find a list of Valerenic Acid manufacturers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PhamaCompass.

Valerenic Acid Suppliers

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

click here to find a list of Valerenic Acid suppliers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PharmaCompass.

Valerenic Acid GMP

Valerenic Acid 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 Valerenic Acid 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 Valerenic Acid GMP manufacturer or Valerenic Acid GMP API supplier for your needs.

Valerenic Acid CoA

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

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

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