Lutetium Lu-177 Zadavotide Guraxetan
(2S)-2-[[(1S)-1-carboxylato-5-[[8-[[(5R)-5-carboxylato-5-[[(2R)-2-[[(2R)-2-[[(4R)-4-carboxylato-4-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]butanoyl]amino]-3-(4-hydroxy-3-iodophenyl)propanoyl]amino]-3-phenylpropanoyl]amino]pentyl]amino]-8-oxooctanoyl]amino]pentyl]carbamoylamino]pentanedioate;hydron;lutetium-177(3+)
Molecular Identity
Lutetium Lu-177 Zadavotide Guraxetan
(2S)-2-[[(1S)-1-carboxylato-5-[[8-[[(5R)-5-carboxylato-5-[[(2R)-2-[[(2R)-2-[[(4R)-4-carboxylato-4-[4,7,10-tris(carboxylatomethyl)-1,4,7,10-tetrazacyclododec-1-yl]butanoyl]amino]-3-(4-hydroxy-3-iodophenyl)propanoyl]amino]-3-phenylpropanoyl]amino]pentyl]amino]-8-oxooctanoyl]amino]pentyl]carbamoylamino]pentanedioate;hydron;lutetium-177(3+)
PubChem CID: 156596527
2D Structure
Properties
C63H89ILuN11O23
Molecular Formula
1672.30
Molecular Weight
g/mol
1671.4615
Exact Mass
Da
541
TPSA
May have limited oral absorption
13
H-Bond Donors
27
H-Bond Acceptors
2550
Complexity
SMILES
Canonical SMILES
SMILES: [H+].[H+].[H+].[H+].[H+].C1CN(CCN(CCN(CCN1CC(=O)[O-])CC(=O)[O-])C(CCC(=O)NC(CC2=CC(=C(C=C2)O)I)C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CCCCNC(=O)CCCCCCC(=O)NCCCCC(C(=O)[O-])NC(=O)NC(CCC(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-])CC(=O)[O-].[Lu+3]Isomeric SMILES
SMILES: [H+].[H+].[H+].[H+].[H+].C1CN(CCN(CCN(CCN1CC(=O)[O-])CC(=O)[O-])[C@H](CCC(=O)N[C@H](CC2=CC(=C(C=C2)O)I)C(=O)N[C@H](CC3=CC=CC=C3)C(=O)N[C@H](CCCCNC(=O)CCCCCCC(=O)NCCCC[C@@H](C(=O)[O-])NC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])C(=O)[O-])C(=O)[O-])CC(=O)[O-].[177Lu+3]Synonyms(19)
G5B860B0G1177Lu-PNT2002LUTETIUM LU 177 PSMA I&TLutetium Lu-177 Zadavotide Guraxetan2447131-70-4(177Lu)Lu-PSMA I&T[177Lu]Lu-PSMA I&TRefChem:1088626Lutetium Lu 177 Zadavotide GuraxetanZADAVOTIDE GURAXETAN LUTETIUM LU-177Lu-177 Psma I&tLutetium (177Lu) zadavotide guraxetanUNII-G5B860B0G1Lutetium (177Lu) zadavotide guraxetan [INN]PNT2002 Lu-177
Data from PubChem (NCBI)
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Drug Network
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