Tapatybė

EINECS 229-540-7

CAS 6598-95-4 · C26H31FO7

01Tapatybė

Lazychem IDLC-15520
CAS RN6598-95-4
PubChem CID111225
Molecular formulaC26H31FO7
Molecular weight474.53 g/mol
IUPAC name2-((2S,6aS,6bS,7aS,8aS,8bS,11aR,12aS,12bS)-2-fluoro-6a,8a,10,10-tetramethyl-4-oxo-1,4,6a,7a,8,8a,11a,12,12a,12b-decahydronaphtho[2',1':4,5]oxireno[2',3':5,6]indeno[1,2-d][1,3]dioxol-8b(2H)-yl)-2-oxoethyl acetate
InChIKeyMQQZOQZVFKAHJB-ANHKYHMRSA-N

02Struktūra ir stereochemija

2D structurePubChem CID 111225
Two-dimensional chemical structure of EINECS 229-540-7, CAS 6598-95-4
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.
SMILESCC(=O)OCC(=O)[C@@]12[C@@H](C[C@@H]3[C@@]1(C[C@H]4[C@@]5([C@H]3C[C@@H](C6=CC(=O)C=C[C@@]65C)F)O4)C)OC(O2)(C)C
InChINenurodyta

03Stereochemistry

The published structure contains 9 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres9Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 512Before 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.

04Statusas Indijoje

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Pavadinimai ir ryšiai

API ir pirminis vaistas

Fluocinonide

Priemaišos ir susiję junginiai

Pavadinimai ir ryšiai

  • Fluocinonide Impurity 3
  • 9beta,11beta-Epoxy-6alpha-fluoro-21-hydroxy-16alpha,17-(isopropylidenedioxy)pregna-1,4-diene-3,20-dione 21-acetate
  • (6alpha,9beta,11beta,16alpha)-21-(Acetyloxy)-9,11-epoxy-6-fluoro-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione
  • [2-[(1S,3S,5S,6S,10R,12S,13S,15S,21S)-15-Fluoro-5,8,8,21-tetramethyl-18-oxo-2,7,9-trioxahexacyclo[11.8.0.01,3.05,12.06,10.016,21]henicosa-16,19-dien-6-yl]-2-oxoethyl] acetate
  • H81530
  • F571491
  • 2-((2S,6aS,6bS,7aS,8aS,8bS,11aR,12aS,12bS)-2-fluoro-6a,8a,10,10-tetramethyl-4-oxo-1,2,4,6a,7a,8,8a,8b,11a,12,12a,12b-dodecahydronaphtho[2',1':4,5]oxireno[2',3':5,6]indeno[1,2-d][1,3]dioxol-8b-yl)-2-oxoethyl acetate
  • 2-(12-Fluoro-4a,6a,8,8-tetramethyl-2-oxo-2,5a,6,6a,9a,10,10a,10b,11,12-decahydro-8H-naphtho[2',1':4,5]oxireno[5,6]indeno[1,2-d][1,3]dioxol-6b(4aH)-yl)-2-oxoethyl acetate
  • 2-[(4aS,4bS,5aS,6aS,6bS,9aR,10aS,10bS,12S)-12-Fluoro-4a,6a,8,8-tetramethyl-2-oxo-2,5a,6,6a,9a,10,10a,10b,11,12-decahydro-8H-naphtho[2',1':4,5]oxireno[5,6]indeno[1,2-d][1,3]dioxol-6b(4aH)-yl]-2-oxoethyl acetate

Priemaišos ir susiję junginiai

06Šaltiniai