MedKoo Cat#: 464730 | Name: Desisobutyryl Ciclesonide
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

Cic2 is an active metabolite of ciclesonide, repressing severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) genomic RNA replication.

Chemical Structure

Desisobutyryl Ciclesonide
Desisobutyryl Ciclesonide
CAS#161115-59-9

Theoretical Analysis

MedKoo Cat#: 464730

Name: Desisobutyryl Ciclesonide

CAS#: 161115-59-9

Chemical Formula: C28H38O6

Exact Mass: 470.2668

Molecular Weight: 470.61

Elemental Analysis: C, 71.46; H, 8.14; O, 20.40

Price and Availability

Size Price Availability Quantity
10mg USD 450.00 2 Weeks
25mg USD 850.00 2 Weeks
100mg USD 1,250.00 2 Weeks
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Synonym
Desisobutyryl ciclesonide; Desisobutyryl-ciclesonide; Desisobutyrylciclesonide; Des-CIC; DesCIC; Des CIC; des-Ciclesonide; desCiclesonide; des Ciclesonide; CIC-AP; Ciclesonide impurity B
IUPAC/Chemical Name
(6aR,6bS,7S,8aS,8bS,10R,11aR,12aS,12bS)-10-cyclohexyl-7-hydroxy-8b-(2-hydroxyacetyl)-6a,8a-dimethyl-1,2,6a,6b,7,8,8a,8b,11a,12,12a,12b-dodecahydro-4H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-4-one
InChi Key
OXPLANUPKBHPMS-ZXBNPROVSA-N
InChi Code
InChI=1S/C28H38O6/c1-26-11-10-18(30)12-17(26)8-9-19-20-13-23-28(22(32)15-29,27(20,2)14-21(31)24(19)26)34-25(33-23)16-6-4-3-5-7-16/h10-12,16,19-21,23-25,29,31H,3-9,13-15H2,1-2H3/t19-,20-,21-,23+,24+,25+,26-,27-,28+/m0/s1
SMILES Code
O=C1C=C[C@]2(C)[C@@]3([H])[C@@H](O)C[C@]4(C)[C@]5(C(CO)=O)O[C@H](C6CCCCC6)O[C@]5([H])C[C@@]4([H])[C@]3([H])CCC2=C1
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 470.61 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Tsuji G, Yonemitsu K, Ito T, Yanase Y, Uema M, Ohoka N, Inoue T, Asakura H, Demizu Y. Development of ciclesonide analogues that block SARS-CoV-2 RNA replication. Bioorg Med Chem Lett. 2021 Apr 20;43:128052. doi: 10.1016/j.bmcl.2021.128052. Epub ahead of print. PMID: 33887440; PMCID: PMC8055493.