MedKoo Cat#: 161197 | Name: WYM76507
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Description:

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

WYM76507, also known as Mn(III) meso-Tetra(4-sulfonatophenyl)porphine chloride (acid form) is a synthetic porphyrin product which is used in the construction of several nanomaterials. WYM76507 has applications as a tumor-selective MRI contrast agent. This product has no formal name at the moment. For the convenience of communication, a temporal code name was therefore proposed according to MedKoo Chemical Nomenclature (see web page: https://www.medkoo.com/page/naming).

Chemical Structure

WYM76507
WYM76507
CAS#221176-50-7

Theoretical Analysis

MedKoo Cat#: 161197

Name: WYM76507

CAS#: 221176-50-7

Chemical Formula: C44H28ClMnN4O12S4

Exact Mass: 1021.9656

Molecular Weight: 1023.35

Elemental Analysis: C, 51.64; H, 2.76; Cl, 3.46; Mn, 5.37; N, 5.47; O, 18.76; S, 12.53

Price and Availability

Size Price Availability Quantity
250mg USD 535.00 2 Weeks
1g USD 950.00 2 Weeks
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Synonym
WYM76507; WYM-76507; WYM 76507; Mn(III) meso-Tetra(4-sulfonatophenyl)porphine chloride (acid form)
IUPAC/Chemical Name
n/a
InChi Key
WMITXTXHDITCGT-YKKPBKTHSA-M
InChi Code
InChI=1S/C44H28N4O12S4.ClH.Mn/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;;/h1-24H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);1H;/q-2;;+3/p-1/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;;
SMILES Code
Cl[Mn](N/12)N3C4=CC=C3/C(C5=CC=C(S(=O)(O)=O)C=C5)=C(C=C6)\N=C6/C(C7=CC=C(S(=O)(O)=O)C=C7)=C2/C=CC1=C(C(C=C/8)=NC8=C4\C9=CC=C(S(=O)(O)=O)C=C9)/C%10=CC=C(S(=O)(O)=O)C=C%10
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 1,023.35 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.) Fiel, et al. Mechanism of the localization of manganese (III) mesotetra(4-sulfonatophenyl)porphine i in mice bearing L1210 tumors. Cancer Letters. Volume 40, Issue 1, May 1988, Pages 23-32. https://doi.org/10.1016/0304-3835(88)90258-3 2.) Schaefle, et al. NMR Paramagnetic Relaxation of the Spin 2 Complex MnIIITSPP:  A Unique Mechanism. J. Phys. Chem. A 2005, 109, 15, 3267–3275. https://doi.org/10.1021/jp046227o 3.) Cheng, et al. Complementary Strategies for Developing Gd-Free High-Field T1 MRI Contrast Agents Based on MnIII Porphyrins. J. Med. Chem. 2014, 57, 2, 516–520. https://doi.org/10.1021/jm401124b 4.) Lu, et al. Manganese(III) porphyrin oligomers as high-relaxivity MRI contrast agents. Bioorganic & Medicinal Chemistry. Volume 35, 1 April 2021, 116090. https://doi.org/10.1016/j.bmc.2021.116090 5.) Wang, et al. Porphyrin-Based Honeycomb Films and Their Antibacterial Activity. Langmuir 2014, 30, 22, 6419–6426. https://doi.org/10.1021/la501244s 6.) Koposova EA, Offenhäusser A, Ermolenko YE and Mourzina YG (2019) Photoresponsive Porphyrin Nanotubes of Meso-tetra(4-Sulfonatophenyl)Porphyrin and Sn(IV) meso-tetra(4-pyridyl)porphyrin. Front. Chem.7:351. doi: 10.3389/fchem.2019.00351