PSMA-I&F
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MedKoo CAT#: 125683

CAS#: N/A

Description: 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

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PSMA-I&F
CAS# N/A
Instruction

Theoretical Analysis

MedKoo Cat#: 125683
Name: PSMA-I&F
CAS#: N/A
Chemical Formula: C101H140I2N15O32S2+
Exact Mass: 2,392.73
Molecular Weight: 2,394.230
Elemental Analysis: C, 50.67; H, 5.89; I, 10.60; N, 8.78; O, 21.38; S, 2.68

Price and Availability

Size Price Availability Quantity
5mg USD 2950 2 Weeks
10mg USD 5250 2 Weeks
100mg USD 12950 2 Weeks
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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

InChi Key: HYEVHTFLPXJHAE-MNDFWDAISA-O

InChi Code: InChI=1S/C101H139I2N15O32S2/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)/p+1/t71-,72?,73?,74?,75-,76-,79?/m1/s1

SMILES Code: OC(CN(CCN(CCN(CC1)CC(O)=O)CC(O)=O)CCN1C(C(O)=O)CCC(N[C@H](CCCCNC(CCCCCN2/C(C(C)(C)C3=C2C=CC(S(=O)(O)=O)=C3)=C/C=C/C=C/C4=[N+](C)C(C=CC(S(=O)(O)=O)=C5)=C5C4(C)C)=O)C(N[C@H](CC6=CC=C(O)C(I)=C6)C(N[C@H](CC7=CC(I)=C(O)C=C7)C(N[C@@H](C(O)=O)CCCCNC(CCCCCCC(NCCCC[C@H](NC(N[C@@H](CCC(O)=O)C(O)=O)=O)C(O)=O)=O)=O)=O)=O)=O)=O)=O

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:

Biological target:
In vitro activity:
In vivo activity:

Preparing Stock Solutions

The following data is based on the product molecular weight 2,394.23 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
Formulation protocol:
In vitro protocol:
In vivo protocol:

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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.