Chemical identity

Tiamulin EP Impurity A / Mutilin

CAS 6040-37-5 · C20H32O3

01Identity

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

Lazychem IDLC-29525
PubChem CID66860774
NameTiamulin EP Impurity A / Mutilin
CAS RN6040-37-5
Molecular formulaC20H32O3
Molecular weight320.47 g/mol
IUPAC name(3aS,4R,5S,6S,8R,9R,9aR,10R)-6-ethenyl-5,8-dihydroxy- 4,6,9,10-tetramethyloctahydro-3a,9-propano-3aHcyclopentacycloocten- 1(4H)-one
InChIKeyOBUUFWIMEGVAQS-JAFVRLMVSA-N

02Structure identifiers

2D structurePubChem CID 66860774
Two-dimensional chemical structure of Tiamulin EP Impurity A / Mutilin, CAS 6040-37-5
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aliphatic carbon, has 8 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres8
Unassigned stereocentres0
Ring count3
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESC[C@@H]1CC[C@@]23CCC(=O)[C@H]2[C@@]1([C@@H](C[C@@]([C@H]([C@@H]3C)O)(C)C=C)O)C
InChINot listed
Formula from structureC20H32O3
Molecular weight from structure320.47 g/mol

03Stereochemistry

The published structure contains 8 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres8Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 256Before 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.

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 6040-37-5 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 6040-37-5 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

Tiamulin

View API and impurity family

Other names

  • Tiamulin EP Impurity A
  • Mutilin
  • 6040-37-5
  • 22KM7GR3SJ
  • RefChem:160212
  • (1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3,6-dihydroxy-2,4,7,14-tetramethyltricyclo[5.4.3.01,8]tetradecan-9-one
  • (3aS,4R,5S,6S,8R,9R,9aR,10R)-6-Ethenyl-5,8-dihydroxy-4,6,9,10-tetramethyloctahydro-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one (Mutilin)
  • Tiamulin Hydrogen Fumarate Imp. A (EP)
  • Tiamulin Imp. A (EP)
  • (3aS,4R,5S,6S,8R,9R,9aR,10R)-6-Ethenyl-5,8-dihydroxy-4,6,9,10-tetramethyloctahydro-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one
  • Tiamulin Hydrogen Fumarate Impurity A
  • Tiamulin Impurity A

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