MedKoo Cat#: 125683 | Name: PSMA-I&F Cl
Featured New

Description:

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

PSMA-I&F is a ligand for making 68Ga/177Lu-PSMA-I&F, which is a PSMA-Targeted Hybrid Tracer. PSMA-I&F is a useful agent for Nuclear and Fluorescence Imaging of Prostate Cancer.

Chemical Structure

PSMA-I&F Cl
PSMA-I&F Cl
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 125683

Name: PSMA-I&F Cl

CAS#: N/A

Chemical Formula: C101H140ClI2N15O32S2

Exact Mass: 2427.7008

Molecular Weight: 2429.68

Elemental Analysis: C, 49.93; H, 5.81; Cl, 1.46; I, 10.45; N, 8.65; O, 21.07; S, 2.64

Price and Availability

Size Price Availability Quantity
5mg USD 2,950.00 2 Weeks
10mg USD 5,250.00 2 Weeks
100mg USD 12,950.00 2 Weeks
Bulk Inquiry
Buy Now
Add to Cart
Related CAS #
No Data
Synonym
PSMA-I&F; PSMAI&F; PSMA I&F
IUPAC/Chemical Name
2-((1E,3E)-5-((E)-3,3-dimethyl-5-sulfo-1-((3S,7S,26R,29R,32R,35R)-1,3,7,26-tetracarboxy-35-(4-carboxy-4-(4,7,10-tris(carboxymethyl)-1,4,7,10-tetraazacyclododecan-1-yl)butanamido)-29,32-bis(4-hydroxy-3-iodobenzyl)-5,13,20,28,31,34,41-heptaoxo-4,6,12,21,27,30,33,40-octaazahexatetracontan-46-yl)indolin-2-ylidene)penta-1,3-dien-1-yl)-1,3,3-trimethyl-5-sulfo-3H-indol-1-ium chloride
InChi Key
ZIRCXDXTDLRTNA-PXOLXQLLSA-N
InChi Code
InChI=1S/C101H139I2N15O32S2.ClH/c1-100(2)67-58-65(151(145,146)147)32-35-77(67)113(5)82(100)25-10-8-11-26-83-101(3,4)68-59-66(152(148,149)150)33-36-78(68)118(83)45-21-9-14-29-86(123)104-42-18-15-22-71(107-87(124)40-37-79(98(142)143)117-52-50-115(61-90(129)130)48-46-114(60-89(127)128)47-49-116(51-53-117)62-91(131)132)92(133)109-76(57-64-31-39-81(120)70(103)55-64)94(135)110-75(56-63-30-38-80(119)69(102)54-63)93(134)108-72(95(136)137)23-16-19-43-105-84(121)27-12-6-7-13-28-85(122)106-44-20-17-24-73(96(138)139)111-99(144)112-74(97(140)141)34-41-88(125)126;/h8,10-11,25-26,30-33,35-36,38-39,54-55,58-59,71-76,79H,6-7,9,12-24,27-29,34,37,40-53,56-57,60-62H2,1-5H3,(H20-,104,105,106,107,108,109,110,111,112,119,120,121,122,123,124,125,126,127,128,129,130,131,132,133,134,135,136,137,138,139,140,141,142,143,144,145,146,147,148,149,150);1H/t71-,72-,73+,74+,75-,76-,79?;/m1./s1
SMILES Code
O=S(C1=CC2=C([N+](C)=C(/C=C/C=C/C=C3N(CCCCCC(NCCCC[C@@H](NC(CCC(C(O)=O)N4CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC4)=O)C(N[C@H](CC5=CC=C(O)C(I)=C5)C(N[C@H](CC6=CC=C(O)C(I)=C6)C(N[C@@H](C(O)=O)CCCCNC(CCCCCCC(NCCCC[C@@H](C(O)=O)NC(N[C@H](C(O)=O)CCC(O)=O)=O)=O)=O)=O)=O)=O)=O)C7=C(C=C(S(=O)(O)=O)C=C7)C/3(C)C)C2(C)C)C=C1)(O)=O.[Cl-]
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 2,429.68 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
Schottelius M, Wurzer A, Wissmiller K, Beck R, Koch M, Gorpas D, Notni J, Buckle T, van Oosterom MN, Steiger K, Ntziachristos V, Schwaiger M, van Leeuwen FWB, Wester HJ. Synthesis and Preclinical Characterization of the PSMA-Targeted Hybrid Tracer PSMA-I&F for Nuclear and Fluorescence Imaging of Prostate Cancer. J Nucl Med. 2019 Jan;60(1):71-78. doi: 10.2967/jnumed.118.212720. Epub 2018 Sep 20. PMID: 30237214; PMCID: PMC6354225.