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Chemistry

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Also known as: Blxa4-methyl ester, Blxa-4-me, Benzo-lxa4-methyl ester, 362516-29-8, Ka6q1qb6db, 7-octenoic acid, 5,6-dihydroxy-8-(2-((1e,3r)-3-hydroxy-1-octen-1-yl)phenyl)-, methyl ester, (5s,6r,7e)-
Molecular Formula
C23H34O5
Molecular Weight
390.5  g/mol
InChI Key
CHUQDPKHYXGMEB-IQOAYPBESA-N
FDA UNII
KA6Q1QB6DB

Blxa4-ME
1 2D Structure

Blxa4-ME

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl (E,5S,6R)-5,6-dihydroxy-8-[2-[(E,3R)-3-hydroxyoct-1-enyl]phenyl]oct-7-enoate
2.1.2 InChI
InChI=1S/C23H34O5/c1-3-4-5-11-20(24)16-14-18-9-6-7-10-19(18)15-17-22(26)21(25)12-8-13-23(27)28-2/h6-7,9-10,14-17,20-22,24-26H,3-5,8,11-13H2,1-2H3/b16-14+,17-15+/t20-,21+,22-/m1/s1
2.1.3 InChI Key
CHUQDPKHYXGMEB-IQOAYPBESA-N
2.1.4 Canonical SMILES
CCCCCC(C=CC1=CC=CC=C1C=CC(C(CCCC(=O)OC)O)O)O
2.1.5 Isomeric SMILES
CCCCC[C@H](/C=C/C1=CC=CC=C1/C=C/[C@H]([C@H](CCCC(=O)OC)O)O)O
2.2 Other Identifiers
2.2.1 UNII
KA6Q1QB6DB
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Blxa4-methyl Ester

2. Blxa-4-me

3. Benzo-lxa4-methyl Ester

4. 362516-29-8

5. Ka6q1qb6db

6. 7-octenoic Acid, 5,6-dihydroxy-8-(2-((1e,3r)-3-hydroxy-1-octen-1-yl)phenyl)-, Methyl Ester, (5s,6r,7e)-

7. Unii-ka6q1qb6db

8. Schembl590253

9. Schembl590256

10. Chembl273012

11. Methyl (e,5s,6r)-5,6-dihydroxy-8-[2-[(e,3r)-3-hydroxyoct-1-enyl]phenyl]oct-7-enoate

12. Q27282146

13. (5s,6r,e)-methyl 5,6-dihydroxy-8-(2((r,e)-3-hydroxyoct-1-enyl)phenyl)oct-7-enoate

14. (5s,6r,e)-methyl 5,6-dihydroxy-8-(2-((r,e)-3-hydroxyoct-1-enyl)phenyl)oct-7-enoate

15. Methyl (5s,6r,e)-5,6-dihydroxy-8-(2-((r,e)-3-hydroxyoct-1-en-1-yl)phenyl)oct-7-enoate

16. (5s,6r,7e)-5,6-dihydroxy-8-[2-[(1e,3r)-3-hydroxy-1-octenyl]phenyl]-7-octenoic Acid Methyl Ester

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 390.5 g/mol
Molecular Formula C23H34O5
XLogP33.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Exact Mass390.24062418 g/mol
Monoisotopic Mass390.24062418 g/mol
Topological Polar Surface Area87 Ų
Heavy Atom Count28
Formal Charge0
Complexity474
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

ABOUT THIS PAGE

Blxa4-ME Manufacturers

A Blxa4-ME manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Blxa4-ME, including repackagers and relabelers. The FDA regulates Blxa4-ME manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Blxa4-ME API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Blxa4-ME Suppliers

A Blxa4-ME supplier is an individual or a company that provides Blxa4-ME active pharmaceutical ingredient (API) or Blxa4-ME finished formulations upon request. The Blxa4-ME suppliers may include Blxa4-ME API manufacturers, exporters, distributors and traders.

click here to find a list of Blxa4-ME suppliers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PharmaCompass.

Blxa4-ME USDMF

A Blxa4-ME DMF (Drug Master File) is a document detailing the whole manufacturing process of Blxa4-ME active pharmaceutical ingredient (API) in detail. Different forms of Blxa4-ME DMFs exist exist since differing nations have different regulations, such as Blxa4-ME USDMF, ASMF (EDMF), JDMF, CDMF, etc.

A Blxa4-ME DMF submitted to regulatory agencies in the US is known as a USDMF. Blxa4-ME USDMF includes data on Blxa4-ME's chemical properties, information on the facilities and procedures used, and details about packaging and storage. The Blxa4-ME USDMF is kept confidential to protect the manufacturer’s intellectual property.

click here to find a list of Blxa4-ME suppliers with USDMF on PharmaCompass.

Blxa4-ME GMP

Blxa4-ME 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 Blxa4-ME 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 Blxa4-ME GMP manufacturer or Blxa4-ME GMP API supplier for your needs.

Blxa4-ME CoA

A Blxa4-ME CoA (Certificate of Analysis) is a formal document that attests to Blxa4-ME's compliance with Blxa4-ME specifications and serves as a tool for batch-level quality control.

Blxa4-ME CoA mostly includes findings from lab analyses of a specific batch. For each Blxa4-ME 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.

Blxa4-ME may be tested according to a variety of international standards, such as European Pharmacopoeia (Blxa4-ME EP), Blxa4-ME JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Blxa4-ME 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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