Produkty 2946600-14-0

CAS 2946600-14-0 to numer rejestracyjny substancji PSMA-IN-2. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.

Wzór strukturalny: {0} (CAS {1})

(2S)-6-[3-[4-[8-[4-[[3-[[(5S)-5-carboxy-5-[[(1S)-1-carboxy-2-[(2-hydroxy-3,4-dioxocyclobuten-1-yl)amino]ethyl]carbamoylamino]pentyl]amino]-3-oxopropyl]-methylamino]phenyl]-5lambda4,11-dithia-4,6,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-1(12),2,4,5,7,9-hexaen-2-yl]-N-methylanilino]propanoylamino]-2-[[(1S)-1-carboxy-2-[(2-hydroxy-3,4-dioxocyclobuten-1-yl)amino]ethyl]carbamoylamino]hexanoic acid (CAS 2946600-14-0) to związek chemiczny o wzorze sumarycznym C54H60N14O18S2 i masie molowej 1257.3 g/mol. Nazwa systematyczna IUPAC: (2S)-6-[3-[4-[8-[4-[[3-[[(5S)-5-carboxy-5-[[(1S)-1-carboxy-2-[(2-hydroxy-3,4-dioxocyclobuten-1-yl)amino]ethyl]carbamoylamino]pentyl]amino]-3-oxopropyl]-methylamino]phenyl]-5lambda4,11-dithia-4,6,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-1(12),2,4,5,7,9-hexaen-2-yl]-N-methylanilino]propanoylamino]-2-[[(1S)-1-carboxy-2-[(2-hydroxy-3,4-dioxocyclobuten-1-yl)amino]ethyl]carbamoylamino]hexanoic acid. InChIKey: SQBTYNFCZAVIEI-YDPTYEFTSA-N.

Dane identyfikacyjne
Wzór sumarycznyC54H60N14O18S2
Masa molowa1257.3 g/mol
Nazwa IUPAC(2S)-6-[3-[4-[8-[4-[[3-[[(5S)-5-carboxy-5-[[(1S)-1-carboxy-2-[(2-hydroxy-3,4-dioxocyclobuten-1-yl)amino]ethyl]carbamoylamino]pentyl]amino]-3-oxopropyl]-methylamino]phenyl]-5lambda4,11-dithia-4,6,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-1(12),2,4,5,7,9-hexaen-2-yl]-N-methylanilino]propanoylamino]-2-[[(1S)-1-carboxy-2-[(2-hydroxy-3,4-dioxocyclobuten-1-yl)amino]ethyl]carbamoylamino]hexanoic acid
InChIKeySQBTYNFCZAVIEI-YDPTYEFTSA-N
SMILESCN(CCC(=O)NCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CNC1=C(C(=O)C1=O)O)C(=O)O)C2=CC=C(C=C2)C3=C4C(=C(C5=NSN=C35)C6=CC=C(C=C6)N(C)CCC(=O)NCCCC[C@@H](C(=O)O)NC(=O)N[C@@H](CNC7=C(C(=O)C7=O)O)C(=O)O)N=S=N4

Dane obliczone przez PubChem (NCBI)

Synonimy: orb2565413