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Home > Encyclopedia > 5′-[[(3S)-3-Amino-3-carboxypropyl]methylsulfonio]-5′-deoxyadenosine

5′-[[(3S)-3-Amino-3-carboxypropyl]methylsulfonio]-5′-deoxyadenosine

pharmaceutical raw materials
5′-[[(3S)-3-Amino-3-carboxypropyl]methylsulfonio]-5′-deoxyadenosine structure

5′-[[(3S)-3-Amino-3-carboxypropyl]methylsulfonio]-5′-deoxyadenosine 

structure
  • CAS No:

    485-80-3

  • Formula:

    C15H23N6O5S

  • Chemical Name:

    5′-[[(3S)-3-Amino-3-carboxypropyl]methylsulfonio]-5′-deoxyadenosine

  • Synonyms:

    Adenosine,5′-[[(3S)-3-amino-3-carboxypropyl]methylsulfonio]-5′-deoxy-;Adenosine,5′-[(3-amino-3-carboxypropyl)methylsulfonio]-5′-deoxy-,(3S)-;Adenosine,5′-[(3-amino-3-carboxypropyl)methylsulfonio]-5′-deoxy-,L-;5′-[[(3S)-3-Amino-3-carboxypropyl]methylsulfonio]-5′-deoxyadenosine;15648-75-6;55722-10-6;93240-48-3

  • Categories:

    Biochemical Engineering  >  Amino Acids and Derivatives

Description

Solid


S-adenosyl-L-methionine is a sulfonium compound that is the S-adenosyl derivative of L-methionine. It is an intermediate in the metabolic pathway of methionine. It has a role as a coenzyme, a nutraceutical, a micronutrient, a human metabolite, a Saccharomyces cerevisiae metabolite, a Mycoplasma genitalium metabolite and a cofactor. It is a conjugate acid of a S-adenosyl-L-methioninate. It is an enantiomer of a S-adenosyl-D-methionine. It is a tautomer of a S-adenosyl-L-methionine zwitterion.|Physiologic methyl radical donor involved in enzymatic transmethylation reactions and present in all living organisms. It possesses anti-inflammatory activity and has been used in treatment of chronic liver disease. (From Merck, 11th ed)

5′-[[(3S)-3-Amino-3-carboxypropyl]methylsulfonio]-5′-deoxyadenosine Basic Attributes

400.45

398.137239

249-946-8

DTXSID6032019|DTXSID20110014|DTXSID40436187

A - Alimentary tract and metabolism

Characteristics

187

-5.3

78°C

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P322, P330, P337+P313, P363, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

Ademetionine

Computed Properties

Molecular Weight:399.4
XLogP3:-3.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:7
Exact Mass:399.14506403
Monoisotopic Mass:399.14506403
Topological Polar Surface Area:184
Heavy Atom Count:27
Formal Charge:1
Complexity:533
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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