Products 1393889-01-4

CAS 1393889-01-4 appears in our catalog under these names: (Lys⁷)–Phalloidin, (Lys7)-Phalloidin trifluoroacetate. Offered by: GLPBio, Biosynth. Available pack sizes: 1mg, 2mg, 5mg, 10mg.

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

(1S,14R,18S,20S,23S,28S,31S,34R)-28-(4-aminobutyl)-18-hydroxy-34-[(1S)-1-hydroxyethyl]-23,31-dimethyl-12-thia-10,16,22,25,27,30,33,36-octazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone;2,2,2-trifluoroacetic acid (CAS 1393889-01-4) is a chemical compound with the molecular formula C37H50F3N9O11S and a molecular weight of 885.9 g/mol. IUPAC name: (1S,14R,18S,20S,23S,28S,31S,34R)-28-(4-aminobutyl)-18-hydroxy-34-[(1S)-1-hydroxyethyl]-23,31-dimethyl-12-thia-10,16,22,25,27,30,33,36-octazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone;2,2,2-trifluoroacetic acid. InChIKey: LYLSNGBZFNPGNJ-FUQRCJCKSA-N.

Identity
Molecular formulaC37H50F3N9O11S
Molecular weight885.9 g/mol
IUPAC name(1S,14R,18S,20S,23S,28S,31S,34R)-28-(4-aminobutyl)-18-hydroxy-34-[(1S)-1-hydroxyethyl]-23,31-dimethyl-12-thia-10,16,22,25,27,30,33,36-octazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone;2,2,2-trifluoroacetic acid
InChIKeyLYLSNGBZFNPGNJ-FUQRCJCKSA-N
SMILESC[C@H]1C(=O)N[C@H]2CC3=C(NC4=CC=CC=C34)SC[C@@H](C(=O)N5C[C@H](C[C@H]5C(=O)N1)O)NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CCCCN)C)[C@H](C)O.C(=O)(C(F)(F)F)O

Computed by PubChem (NCBI)