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Chemistry

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Also known as: Chebi:28462, Ncgc00016987-01, Ajimalin (tn), Ajmaline (jp17), Dsstox_cid_25537, Dsstox_rid_80939
Molecular Formula
C20H26N2O2
Molecular Weight
326.4  g/mol
InChI Key
CJDRUOGAGYHKKD-HEFSZTOGSA-N

Ajmaline
ajmaline is a natural product found in Euglena gracilis and Apis cerana with data available.
1 2D Structure

Ajmaline

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1R,9R,10S,12R,13S,14R,16S,18R)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
2.1.2 InChI
InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11-,14-,15-,16?,17-,18+,19+,20+/m0/s1
2.1.3 InChI Key
CJDRUOGAGYHKKD-HEFSZTOGSA-N
2.1.4 Canonical SMILES
CCC1C2CC3C4C5(CC(C2C5O)N3C1O)C6=CC=CC=C6N4C
2.1.5 Isomeric SMILES
CC[C@H]1[C@@H]2C[C@H]3[C@H]4[C@@]5(C[C@@H](C2[C@H]5O)N3[C@@H]1O)C6=CC=CC=C6N4C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Chebi:28462

2. Ncgc00016987-01

3. Ajimalin (tn)

4. Ajmaline (jp17)

5. Dsstox_cid_25537

6. Dsstox_rid_80939

7. Dsstox_gsid_45537

8. Schembl18950

9. Ajmalan-17alpha,21alpha-diol

10. Chembl2357792

11. Hy-b1167

12. Tox21_110728

13. 4-formylphenyl4-formylbenzoate

14. Akos037515833

15. Cs-4769

16. Db01426

17. Cas-4360-12-7

18. D00199

19. Q385858

20. (1r,9r,10s,12r,13s,14r,16s,18r)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.0^{1,9}.0^{2,7}.0^{10,15}.0^{12,17}]nonadeca-2,4,6-triene-14,18-diol

2.3 Create Date
2004-09-16
3 Chemical and Physical Properties
Molecular Weight 326.4 g/mol
Molecular Formula C20H26N2O2
XLogP31.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass326.199428076 g/mol
Monoisotopic Mass326.199428076 g/mol
Topological Polar Surface Area46.9 Ų
Heavy Atom Count24
Formal Charge0
Complexity570
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Indication

For use as an antiarrhythmic agent.


5 Pharmacology and Biochemistry
5.1 Pharmacology

Ajmaline is a class 1A antiarrhythmic agent. By interfering with the sodium channels, this drug allows for improvement in abnormal rhythms of the heart


5.2 Mechanism of Action

The class I antiarrhythmic agents interfere with the sodium channel. A class IA agent lengthens the action potential (right shift) which brings about improvement in abnormal heart rhythms. This drug in particular has a high affinity for the Nav 1.5 sodium channel.


API SUPPLIERS

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Transo-Pharm Handels GmbH

Germany

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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Medlab Asia & Asia Health
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Virtual BoothTranso-Pharm GmbH works globally to supply Active Pharmaceutical Ingredients adhering to the highest quality & GMP standards.

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Transo Pharm Handels GmbH

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DKSH

Switzerland

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothDKSH is your trusted partner for companies looking to grow their business in Asia & beyond.

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USDMF CEP/COS JDMF EU-WC NDC KDMF VMF Others AUDIT
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Alkaloids Corporation

India

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

Medlab Asia & Asia Health
Not Confirmed
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Alkaloids Corporation

India

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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Medlab Asia & Asia Health
Not Confirmed
USDMF CEP/COS JDMF EU-WCInactive-api NDC KDMF VMF Others AUDIT
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EU WC

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Medlab Asia & Asia Health
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Ajmaline IH

Date of Issue : 2020-01-29

Valid Till : 2022-07-02

Written Confirmation Number : WC-0192

Address of the Firm : 834 P, Medchal-Malkajgiri District, Telangana-500 100, India

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Listed Suppliers

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01

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Medlab Asia & Asia Health
Not Confirmed
  • fda
  • EDQM
  • WHO-GMP

Virtual BoothTranso-Pharm GmbH works globally to supply Active Pharmaceutical Ingredients adhering to the highest quality & GMP standards.

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Digital Content Digital Content

Ajmaline

About the Company : Founded in 1987, Transo-Pharm is a fully licensed and certified global distributor of pharmaceutical components for the health and veterinary industries. The company supports its c...

Founded in 1987, Transo-Pharm is a fully licensed and certified global distributor of pharmaceutical components for the health and veterinary industries. The company supports its customers throughout the complete lifecycle of APIs, from product development to market research, sourcing, import-export and sales. Transo-Pharm offers a diverse range of products. It qualifies manufacturers for full compliance and serves both as a valuable sourcing agent for its clients and a regulatory marketing agent for API manufacturers. It has offices in Shanghai, Hong Kong, Singapore, the United States, and an affiliated office in Mumbai.
Transo Pharm Handels GmbH

02

DKSH

Switzerland
  • fda
  • EDQM
  • WHO-GMP

Virtual BoothDKSH is your trusted partner for companies looking to grow their business in Asia & beyond.

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Digital Content Digital Content

Ajmaline

About the Company : DKSH, founded with the goal of improving people's lives, assists businesses with market expansion and business growth in both existing and emerging markets. It has been fostering g...

DKSH, founded with the goal of improving people's lives, assists businesses with market expansion and business growth in both existing and emerging markets. It has been fostering growth for businesses in Asia and beyond for over 155 years. DKSH operates in 36 markets, is listed on the SIX Swiss Exchange, employs 33,100 specialists, and generated net sales of CHF 11.1 billion in 2021. It is the leading global distributor of innovative pharma ingredients for pharmaceutical synthesis and formulation. It offers a range of products, ranging from animal care products to packaging materials, intermediates to nutraceuticals, and APIs to excipients.
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03

Medlab Asia & Asia Health
Not Confirmed
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Medlab Asia & Asia Health
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Ajmaline

About the Company : Alkaloids is a family company established in 1967. Starting with production of natural Caffeine, quite a number of speciality products have been added to our portfolio. The Compa...

Alkaloids is a family company established in 1967. Starting with production of natural Caffeine, quite a number of speciality products have been added to our portfolio. The Company is dedicated to identification, development, production & distribution of potent Phytochemicals and Botanical extracts. A number of Phytochemicals manufactured by Alkaloids are used as Active Pharmaceutical Ingredients by major drug formulators the world over. We are internationally recognised as a reliable supplier of high quality Phyto-products. Alkaloids also manufactures custom-made products on exclusive basis for our valued customers.
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