3'-Iodo-4'-Azidosalicylamidoethylamido-7-Succinyldeacetylforskolin
[CAS# 121878-20-4]

Identification

• Name: 3'-Iodo-4'-Azidosalicylamidoethylamido-7-Succinyldeacetylforskolin
• Synonyms: [(3R,4As,5R,6R,6Ar,10R,10As,10Br)-6,10,10B-Trihydroxy-3,4A,7,7,10A-Pentamethyl-1-Oxo-3-Vinyl-5,6,6A,8,9,10-Hexahydro-2H-Benzo[F]Chromen-5-Yl] 4-[2-[(4-Azido-2-Hydroxy-3-Iodo-Benzoyl)Amino]Ethylamino]-4-Oxo-Butanoate; 4-[2-[[(4-Azido-2-Hydroxy-3-Iodophenyl)-Oxomethyl]Amino]Ethylamino]-4-Oxobutanoic Acid [(3R,4As,5R,6R,6Ar,10R,10As,10Br)-6,10,10B-Trihydroxy-3,4A,7,7,10A-Pentamethyl-1-Oxo-3-Vinyl-5,6,6A,8,9,10-Hexahydro-2H-Benzo[F]Chromen-5-Yl] Ester; 4-[2-[(4-Azido-2-Hydroxy-3-Iodo-Benzoyl)Amino]Ethylamino]-4-Keto-Butyric Acid [(3R,4As,5R,6R,6Ar,10R,10As,10Br)-6,10,10B-Trihydroxy-1-Keto-3,4A,7,7,10A-Pentamethyl-3-Vinyl-5,6,6A,8,9,10-Hexahydro-2H-Benzo[F]Chromen-5-Yl] Ester
• Molecular Formula: C₃₃H₄₄IN₅O₁₀
• Molecular Weight: 797.64
• CAS Registry Number: 121878-20-4
• SMILES: [N+](=NC4=CC=C(C(NCCNC(CCC(=O)O[C@H]2[C@]1([C@@](C(C[C@](O1)(C)C=C)=O)([C@]3([C@H]([C@H]2O)C(CC[C@H]3O)(C)C)C)O)C)=O)=O)C(=C4I)O)=[N-]
• InChI: 1S/C33H44IN5O10/c1-7-30(4)16-20(41)33(47)31(5)19(40)12-13-29(2,3)26(31)25(45)27(32(33,6)49-30)48-22(43)11-10-21(42)36-14-15-37-28(46)17-8-9-18(38-39-35)23(34)24(17)44/h7-9,19,25-27,40,44-45,47H,1,10-16H2,2-6H3,(H,36,42)(H,37,46)/t19-,25-,26-,27-,30+,31-,32+,33-/m1/s1
• InChIKey: UTCUSMOTNRCVGL-JFHNSAMMSA-N