API and parent drug

Spermine

CAS 71-44-3 · C10H26N4 · 2 related records

01API identity and structure

2D structurePubChem CID 1103
Two-dimensional chemical structure of Spermine, CAS 71-44-3
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure is acyclic, includes aliphatic carbon. These statements are calculated from the published structure string.

API / medicine nameSpermine
CAS RN71-44-3
PubChem CID1103
Molecular formulaC10H26N4
Molecular weight202.34 g/mol
IUPAC nameN,N'-bis(3-aminopropyl)butane-1,4-diamine
Defined stereocentres0
Unassigned stereocentres0
SMILESC(CCNCCCN)CNCCCN
InChINot listed
InChIKeyPFNFFQXMRSDOHW-UHFFFAOYSA-N

02Structural nitrosamine screen

This is a structure-only screen for the API. It does not predict manufacturing conditions, nitrite exposure, reaction kinetics or analytical results.

N-nitroso groupNot detected

Direct N-nitroso substructure search.

Secondary amine2 sites

A detected secondary amine is a structural alert that requires process-specific assessment.

Tertiary N-methyl amineNot detected

N-dealkylation can be relevant to impurity pathway assessment. A methyl group elsewhere in the molecule is not treated as a nitrosamine alert.

Interpretation: Formation potential cannot be concluded from structure alone. Review the synthesis, recovered solvents, amine reagents, nitrite sources, pH, temperature and purge controls.

03India status for this compound

The result below applies only to this exact compound identity and CAS number.

NDPS / RCSNO EXACT MATCH FOUNDNo exact match for this compound is present in the reviewed record. Confirm against the current official schedule before making a regulatory decision.
SCOMETNO EXACT CAS MATCH FOUNDCAS 71-44-3 does not have an exact match in the reviewed SCOMET entries.
Review date2026-08-01Check the current official instruments for the material, activity and date in question.

05Sources

  • S01
    PubChem compound record, CID 1103

    Structure, identifiers and machine-readable properties for the API identity.

  • S02
    NCBI website and molecular data policies

    Reuse policy for NCBI molecular data. Vendor descriptions and contributed narrative text are not reproduced.

  • S03
    Lazychem chemical records

    Parent-family links are exact normalized matches to the supplied parent field. Structural alerts are calculated from the published API structure.