Products 3094583-35-1

CAS 3094583-35-1 is the registry number for LD-38. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

3-[2-[[(4S)-4-[[(2S)-2-[3-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-3-methylbutanoyl]amino]-5-[4-[[(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]carbamoyloxymethyl]anilino]-5-oxopentanoyl]amino]ethyl-dimethylazaniumyl]propane-1-sulfonate (CAS 3094583-35-1) is a chemical compound with the molecular formula C67H87FN10O20S and a molecular weight of 1403.5 g/mol. IUPAC name: 3-[2-[[(4S)-4-[[(2S)-2-[3-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-3-methylbutanoyl]amino]-5-[4-[[(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]carbamoyloxymethyl]anilino]-5-oxopentanoyl]amino]ethyl-dimethylazaniumyl]propane-1-sulfonate. InChIKey: VNYCOOMUHCTISP-GFFSSVBXSA-N.

Identity
Molecular formulaC67H87FN10O20S
Molecular weight1403.5 g/mol
IUPAC name3-[2-[[(4S)-4-[[(2S)-2-[3-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-3-methylbutanoyl]amino]-5-[4-[[(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]carbamoyloxymethyl]anilino]-5-oxopentanoyl]amino]ethyl-dimethylazaniumyl]propane-1-sulfonate
InChIKeyVNYCOOMUHCTISP-GFFSSVBXSA-N
SMILESCC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C5[C@H](CCC6=C5C(=CC(=C6C)F)N=C4C3=C2)NC(=O)OCC7=CC=C(C=C7)NC(=O)[C@H](CCC(=O)NCC[N+](C)(C)CCCS(=O)(=O)[O-])NC(=O)[C@H](C(C)C)NC(=O)CCOCCOCCOCCOCCNC(=O)CCN8C(=O)C=CC8=O)O

Computed by PubChem (NCBI)

Synonyms: orb3173110