Chemical identity

Testosterone Enantate EP Impurity B / Testosterone Caproate / Testosterone 17-caproate / Testosterone Enanthate related compound B / Testosterone Isocaproate EP Impurity E

CAS 10312-45-5 · C25H38O3

01Identity

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

Lazychem IDLC-29295
PubChem CID112100
NameTestosterone Enantate EP Impurity B / Testosterone Caproate / Testosterone 17-caproate / Testosterone Enanthate related compound B / Testosterone Isocaproate EP Impurity E
CAS RN10312-45-5
Molecular formulaC25H38O3
Molecular weight386.6 g/mol
IUPAC name3-Oxoandrost-4-en-17B-yl hexanoate
InChIKeyWIGTZVOQGIFMAV-BKWLFHPQSA-N

02Structure identifiers

2D structurePubChem CID 112100
2D structure: Testosterone Enantate EP Impurity B / Testosterone Caproate / Testosterone 17-caproate / Testosterone Enanthate related compound B / Testosterone Isocaproate EP Impurity E, CAS 10312-45-5
Structure of Testosterone Enantate EP Impurity B / Testosterone Caproate / Testosterone 17-caproate / Testosterone Enanthate related compound B / Testosterone Isocaproate EP Impurity E (CAS 10312-45-5). LazyChem record. Source identity: PubChem CID 112100. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC25H38O3
InChIKeyWIGTZVOQGIFMAV-BKWLFHPQSA-N
Ring count4
Defined stereocentres6
Unassigned stereocentres0
SMILESCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C
InChIInChI=1S/C25H38O3/c1-4-5-6-7-23(27)28-22-11-10-20-19-9-8-17-16-18(26)12-14-24(17,2)21(19)13-15-25(20,22)3/h16,19-22H,4-15H2,1-3H3/t19-,20-,21-,22-,24-,25-/m0/s1

03Stereochemistry

The published structure contains 6 defined and 0 unassigned tetrahedral stereocentres. The exact wedge-and-dash depiction is shown above.

Defined stereocentres62D structure
Unassigned stereocentres02D structure
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 64Before 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 / RCSNOT FOUND IN REVIEWED ENTRIESCAS 10312-45-5 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 10312-45-5 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Testosterone

View API and impurity family

Other names

  • Testosterone Caproate
  • TESTOSTERONE HEXANOATE
  • UNII-7CC0L7J83H
  • 17beta-Hydroxyandrost-4-en-3-one hexanoate
  • EINECS 233-690-9
  • [(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl] hexanoate
  • TESTOSTERONE 17-CAPROATE
  • TESTOSTERONE CAPROATE [WHO-DD]
  • TESTOSTERONE CAPRYLATE [NFLIS-DRUG]
  • 3-OXOANDROST-4-EN-17BETA-YL HEXANOATE

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