Chemical identity

Biotin EP Impurity D/ 9-Methyl Biotin

CAS 415725-35-8 · C11H18N2O3S

01Identity

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

Lazychem IDLC-08296
PubChem CID71750228
NameBiotin EP Impurity D/ 9-Methyl Biotin
CAS RN415725-35-8
Molecular formulaC11H18N2O3S
Molecular weight258.34 g/mol
IUPAC name2-methyl-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid
InChIKeyUBBSLIBPXCFHDN-UYXKVSBOSA-N

02Structure identifiers

2D structurePubChem CID 71750228
Two-dimensional chemical structure of Biotin EP Impurity D/ 9-Methyl Biotin, CAS 415725-35-8
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aliphatic carbon, has 3 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres3
Unassigned stereocentres1
Ring count2
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESCC(CCC[C@H]1[C@@H]2[C@H](CS1)NC(=O)N2)C(=O)O
InChINot listed
Formula from structureC11H18N2O3S
Molecular weight from structure258.34 g/mol

03Stereochemistry

The published structure contains 3 defined and 1 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres3Structure assigned
Unassigned centres1Structure unspecified
Assignment statusPartially 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 415725-35-8 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 415725-35-8 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

Biotin

View API and impurity family

Other names

  • Biotin EP Impurity D
  • 9-Methyl Biotin
  • (3aS,4S,6aR)-Hexahydro-α-methyl-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoic Acid
  • 2-Methyl-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno(3,4-d)imidazol-4-yl)pentanoic acid
  • 415725-35-8
  • DTXSID80858021
  • RefChem:1063747
  • DTXCID20808762
  • methyl biotin
  • Biotin Impurity D
  • 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-2-methylpentanoic acid
  • (3aS,4S,6aR)-Hexahydro-a-methyl-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoic Acid

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