Products 3053688-78-8

CAS 3053688-78-8 appears in our catalog under these names: Gly–Gly–Phe–Gly–NH–O–CO–Exatecan hydrochloride, Gly-Gly-Phe-Gly-NH-O-CO-Exatecan (hydrochloride), 99.88%. Offered by: GLPBio, MedChemExpress. Available pack sizes: 5mg, 100 mg, 25 mg, 50 mg, 5 mg, 10 mg.

Structural formula: {0} (CAS {1})

(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-N-[2-[[2-[[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]amino]-2-oxoethoxy]methylamino]-2-oxoethyl]-3-phenylpropanamide;hydrochloride (CAS 3053688-78-8) is a chemical compound with the molecular formula C42H46ClFN8O10 and a molecular weight of 877.3 g/mol. IUPAC name: (2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-N-[2-[[2-[[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]amino]-2-oxoethoxy]methylamino]-2-oxoethyl]-3-phenylpropanamide;hydrochloride. InChIKey: TVQVPAWTGTVHQV-SQLCOBTASA-N.

Identity
Molecular formulaC42H46ClFN8O10
Molecular weight877.3 g/mol
IUPAC name(2S)-2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-N-[2-[[2-[[(10S,23S)-10-ethyl-18-fluoro-10-hydroxy-19-methyl-5,9-dioxo-8-oxa-4,15-diazahexacyclo[14.7.1.02,14.04,13.06,11.020,24]tetracosa-1,6(11),12,14,16,18,20(24)-heptaen-23-yl]amino]-2-oxoethoxy]methylamino]-2-oxoethyl]-3-phenylpropanamide;hydrochloride
InChIKeyTVQVPAWTGTVHQV-SQLCOBTASA-N
SMILESCC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C5[C@H](CCC6=C5C(=CC(=C6C)F)N=C4C3=C2)NC(=O)COCNC(=O)CNC(=O)[C@H](CC7=CC=CC=C7)NC(=O)CNC(=O)CN)O.Cl

Computed by PubChem (NCBI)