MedKoo Biosciences, Inc.
Tel:   +1-919-636-5577    Fax:   +1-919-980-4831    Email:   sales@medkoo.com
Search
Login Register
Search
MedKoo Cat#: 126011 | Name: AH-111501 sodium

Description:

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

AH-111501 is a hyperpolarized agent for use in in-vivo MR diagnostic imaging, the use thereof as MRI contrast agent in investigation methods for producing diagnostic MR images of an organ, region or tissue.

Chemical Structure

AH-111501 sodium
AH-111501 sodium
CAS#874536-54-6 (sodium)

Theoretical Analysis

MedKoo Cat#: 126011

Name: AH-111501 sodium

CAS#: 874536-54-6 (sodium)

Chemical Formula: C64H84Na3O18S12

Exact Mass: 1593.1999

Molecular Weight: 1595.05

Elemental Analysis: C, 48.19; H, 5.31; Na, 4.32; O, 18.05; S, 24.12

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
Bulk Inquiry
Related CAS #
874618-81-2 (free base) 874536-54-6 (sodium)
Synonym
AH-111501 SODIUM; AH-111-501 SODIUM SALT; AH-111501 SODIUM SALT; AH111501 SODIUM SALT; OX 063ME
IUPAC/Chemical Name
sodium 8,8',8''-(l3-methanetriyl)tris(2,2,6,6-tetrakis(2-methoxyethyl)benzo[1,2-d:4,5-d']bis([1,3]dithiole)-4-carboxylate)
InChi Key
NIBTZYPZAFGOSB-UHFFFAOYSA-K
InChi Code
InChI=1S/C64H87O18S12.3Na/c1-71-25-13-59(14-26-72-2)83-44-38(45-51(41(56(65)66)50(44)89-59)90-60(84-45,15-27-73-3)16-28-74-4)37(39-46-52(91-61(85-46,17-29-75-5)18-30-76-6)42(57(67)68)53-47(39)86-62(92-53,19-31-77-7)20-32-78-8)40-48-54(93-63(87-48,21-33-79-9)22-34-80-10)43(58(69)70)55-49(40)88-64(94-55,23-35-81-11)24-36-82-12;;;/h13-36H2,1-12H3,(H,65,66)(H,67,68)(H,69,70);;;/q;3*+1/p-3
SMILES Code
COCCC1(SC2=C(C(C([O-])=O)=C3SC(CCOC)(SC3=C2[C](C4=C5SC(CCOC)(SC5=C(C6=C4SC(CCOC)(S6)CCOC)C([O-])=O)CCOC)C7=C8SC(CCOC)(SC8=C(C9=C7SC(CCOC)(S9)CCOC)C([O-])=O)CCOC)CCOC)S1)CCOC.[Na+].[Na+].[Na+]
Appearance
To be determined
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 1,595.05 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
Radaelli A, Yoshihara HAI, Nonaka H, Sando S, Ardenkjaer-Larsen JH, Gruetter R, Capozzi A. 13C Dynamic Nuclear Polarization using SA-BDPA at 6.7 T and 1.1 K: Coexistence of Pure Thermal Mixing and Well-Resolved Solid Effect. J Phys Chem Lett. 2020 Aug 20;11(16):6873-6879. doi: 10.1021/acs.jpclett.0c01473. Epub 2020 Aug 10. PMID: 32787205.