Chemical identity

Adenosyl Methionine Impurity-1/ 5'-Deoxy-5'-methylthioadenosine

CAS 2457-80-9 · C11H15N5O3S

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-05085
PubChem CID439176
NameAdenosyl Methionine Impurity-1/ 5'-Deoxy-5'-methylthioadenosine
CAS RN2457-80-9
Molecular formulaC11H15N5O3S
Molecular weight297.33 g/mol
IUPAC name(2R,3R,4S,5S)-2-(6-amino-9H-purin-9-yl)-5-((methylthio)methyl)tetrahydrofuran-3,4-diol
InChIKeyWUUGFSXJNOTRMR-IOSLPCCCSA-N

02Structure identifiers

2D structurePubChem CID 439176
Two-dimensional chemical structure of Adenosyl Methionine Impurity-1/ 5'-Deoxy-5'-methylthioadenosine, CAS 2457-80-9
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, has 4 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres4
Unassigned stereocentres0
Ring count3
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESCSC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O
InChINot listed
Formula from structureC11H15N5O3S
Molecular weight from structure297.33 g/mol

03Stereochemistry

The published structure contains 4 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres4Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 16Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNO EXACT MATCH FOUNDCAS 2457-80-9 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 2457-80-9 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

05Names and relationships

Associated parent compound

Adenosyl-L-Methionine

View associated product family

Other names

  • Adenosyl Methionine Impurity 1
  • 5'-Deoxy-5'-methylthioadenosine
  • Methylthioadenosine
  • Vitamin L(sub 2)
  • 5'-deoxy-5'-(methylsulfanyl)adenosine
  • 9-(5-S-methyl-5-thio-beta-D-ribofuranosyl)-9H-purin-6-amine
  • 5-Methyl-Thioadenosine
  • S-methyl-5-thioadenosine
  • 5'-S-methyl-5'-thioadenosine
  • 5'-S-Methylthioadenosine
  • 5'-Deoxy(methylthio)adenosine
  • NSC 335422

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources