CAS 3066439-94-6 to numer rejestracyjny substancji DOTA-GPC3 targeting peptide 2, 99.04%. Oferty producentów: MedChemExpress. Dostępne opakowania: 1 mg, 5 mg, 10 mg.
4-[[(5S,8S,11S,14S,17S,20S,23S,26S,29S,35S,38R)-14-(3-amino-3-oxopropyl)-8,23-bis[(2S)-butan-2-yl]-38-carbamoyl-26-[[4-(carboxymethoxy)phenyl]methyl]-11-(carboxymethyl)-29-(isoquinolin-7-ylmethyl)-20-[(1R)-1-methoxyethyl]-4,7,13,28,37-pentamethyl-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxo-35-[(6-phenyl-3-pyridinyl)methyl]-5-[4-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]butyl]-1-thia-4,7,10,13,16,19,22,25,28,31,34,37-dodecazacyclononatriacont-17-yl]methyl]benzoic acid (CAS 3066439-94-6) to związek chemiczny o wzorze sumarycznym C107H145N21O29S i masie molowej 2221.5 g/mol. Nazwa systematyczna IUPAC: 4-[[(5S,8S,11S,14S,17S,20S,23S,26S,29S,35S,38R)-14-(3-amino-3-oxopropyl)-8,23-bis[(2S)-butan-2-yl]-38-carbamoyl-26-[[4-(carboxymethoxy)phenyl]methyl]-11-(carboxymethyl)-29-(isoquinolin-7-ylmethyl)-20-[(1R)-1-methoxyethyl]-4,7,13,28,37-pentamethyl-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxo-35-[(6-phenyl-3-pyridinyl)methyl]-5-[4-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]butyl]-1-thia-4,7,10,13,16,19,22,25,28,31,34,37-dodecazacyclononatriacont-17-yl]methyl]benzoic acid. InChIKey: KMKDVRYUNUHHJU-XLIZIZITSA-N.
| Wzór sumaryczny | C107H145N21O29S |
|---|---|
| Masa molowa | 2221.5 g/mol |
| Nazwa IUPAC | 4-[[(5S,8S,11S,14S,17S,20S,23S,26S,29S,35S,38R)-14-(3-amino-3-oxopropyl)-8,23-bis[(2S)-butan-2-yl]-38-carbamoyl-26-[[4-(carboxymethoxy)phenyl]methyl]-11-(carboxymethyl)-29-(isoquinolin-7-ylmethyl)-20-[(1R)-1-methoxyethyl]-4,7,13,28,37-pentamethyl-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxo-35-[(6-phenyl-3-pyridinyl)methyl]-5-[4-[[2-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetyl]amino]butyl]-1-thia-4,7,10,13,16,19,22,25,28,31,34,37-dodecazacyclononatriacont-17-yl]methyl]benzoic acid |
| InChIKey | KMKDVRYUNUHHJU-XLIZIZITSA-N |
| SMILES | CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N([C@H](C(=O)NCC(=O)N[C@H](C(=O)N([C@@H](CSCC(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)[C@@H](C)OC)CC2=CC=C(C=C2)C(=O)O)CCC(=O)N)C)CC(=O)O)[C@@H](C)CC)C)CCCCNC(=O)CN3CCN(CCN(CCN(CC3)CC(=O)O)CC(=O)O)CC(=O)O)C)C(=O)N)C)CC4=CN=C(C=C4)C5=CC=CC=C5)CC6=CC7=C(C=C6)C=CN=C7)C)CC8=CC=C(C=C8)OCC(=O)O |
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