WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 527204
CAS#: 189498-56-4; 189498-57-5
Description: ABT-080, also known as VML-530, is a leukotriene synthesis inhibitor potentially for treatment of asthma.
MedKoo Cat#: 527204
Name: ABT-080
CAS#: 189498-56-4; 189498-57-5
Chemical Formula: C37H31N2NaO4
Exact Mass:
Molecular Weight: 590.6548
Elemental Analysis: C, 75.24; H, 5.29; N, 4.74; Na, 3.89; O, 10.83
This product is not in stock, which may be available by custom synthesis.
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Synonym: ABT-080; ABT080; ABT 080; VML-530; VML530; VML 530
IUPAC/Chemical Name: sodium 4,4-bis(4-(quinolin-2-ylmethoxy)phenyl)pentanoate
InChi Key: IQIPMOPRODKMFM-UHFFFAOYSA-M
InChi Code: InChI=1S/C37H32N2O4.Na/c1-37(23-22-36(40)41,28-12-18-32(19-13-28)42-24-30-16-10-26-6-2-4-8-34(26)38-30)29-14-20-33(21-15-29)43-25-31-17-11-27-7-3-5-9-35(27)39-31;/h2-21H,22-25H2,1H3,(H,40,41);/q;+1/p-1
SMILES Code: O=C([O-])CCC(C1=CC=C(OCC2=NC3=CC=CC=C3C=C2)C=C1)(C)C4=CC=C(OCC5=NC6=CC=CC=C6C=C5)C=C4.[Na+]
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: Soluble in DMSO
Shelf Life: >2 years if stored properly
Drug Formulation: This drug may be formulated in DMSO
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
The following data is based on the product molecular weight 590.6548 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 |
1: Kolasa T, Gunn DE, Bhatia P, Basha A, Craig RA, Stewart AO, Bouska JB, Harris RR, Hulkower KI, Malo PE, Bell RL, Carter GW, Brooks CD. Symmetrical bis(heteroarylmethoxyphenyl)alkylcarboxylic acids as inhibitors of leukotriene biosynthesis. J Med Chem. 2000 Aug 24;43(17):3322-34. PubMed PMID: 10966751.
Related CAS#:
189498-56-4 (ABT-080)
189498-57-5 (ABT-080)
