WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H112097
CAS#: 79541-43-8 (Acyl Glucuronide)
Description: Etodolac acyl glucuronide is a phase II metabolite of the non-steroidal anti-inflammatory drug (NSAID) and COX inhibitor etodolac.
Hodoodo Cat#: H112097
Name: Etodolac Acyl Glucuronide
CAS#: 79541-43-8 (Acyl Glucuronide)
Chemical Formula: C23H29NO9
Exact Mass: 463.18
Molecular Weight: 463.480
Elemental Analysis: C, 59.60; H, 6.31; N, 3.02; O, 31.07
Related CAS #: 150975-87-4 (sodium) 79541-43-8 (Acyl Glucuronide) 41340-25-4 (free base)
Synonym: Etodolac Acyl Glucuronide
IUPAC/Chemical Name: (2S,3S,4S,5R,6S)-6-(2-(1,8-diethyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-yl)acetoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
InChi Key: XJZNMEMKZBFUIZ-GWDFKZQESA-N
InChi Code: InChI=1S/C23H29NO9/c1-3-11-6-5-7-12-13-8-9-31-23(4-2,20(13)24-15(11)12)10-14(25)32-22-18(28)16(26)17(27)19(33-22)21(29)30/h5-7,16-19,22,24,26-28H,3-4,8-10H2,1-2H3,(H,29,30)/t16-,17-,18+,19-,22+,23?/m0/s1
SMILES Code: CCC1=C2C(C(CCOC3(CC(O[C@@H]4O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]4O)=O)CC)=C3N2)=CC=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:
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The following data is based on the product molecular weight 463.48 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.
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 |
Formulation protocol: | |
In vitro protocol: | |
In vivo protocol: |