API and parent drug

Trenbolone Acetate

CAS 10161-34-9 · C20H24O3 · 1 related records

01API identity and structure

2D structurePubChem CID 66359
2D structure: Trenbolone Acetate, CAS 10161-34-9
Structure of Trenbolone Acetate (CAS 10161-34-9). LazyChem record. Source identity: PubChem CID 66359. Confirm the identifiers before analytical use.Download structure image
API / medicine nameTrenbolone Acetate
CAS RN10161-34-9
PubChem CID66359
Molecular formulaC20H24O3
Molecular weight312.4 g/mol
IUPAC name[(8S,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,14,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
Defined stereocentres4
Unassigned stereocentres0
SMILESCC(=O)O[C@H]1CC[C@@H]2[C@@]1(C=CC3=C4CCC(=O)C=C4CC[C@@H]23)C
InChINot listed
InChIKeyCMRJPMODSSEAPL-FYQPLNBISA-N

02Stereochemistry

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

Defined stereocentres42D structure
Unassigned stereocentres02D structure
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 16Before symmetry reduction

Published same-connectivity configurations

2 records

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.

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.

03Structural nitrosamine screen

Record-level resultNo candidate is published

No record-level structural candidate is currently published for this identity.

This result does not predict manufacturing conditions, formation, analytical findings or absence of risk. A process-specific assessment is required.

04India status for this compound

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

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESNo exact reviewed identity entry was found. Generic, class, analogue, salt and isomer provisions were not evaluated. Confirm the current official schedule before a regulatory decision.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 10161-34-9 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

06Sources