3-(3-Iodo-4-hydroxyphenyl)propionamide derivative of 6-(2-aminoethyl)aminocarbonylforskolin
[CAS# 135159-46-5]

Identification

• Name: 3-(3-Iodo-4-hydroxyphenyl)propionamide derivative of 6-(2-aminoethyl)aminocarbonylforskolin
• Synonyms: 6-125I-Hpp-Fsk; 6-I-Hpp-Fsk; Carbamic Acid, (2-((3-(4-Hydroxy-5-(Iodo-125I)Phenyl)-1-Oxopropyl)Amino)Ethyl)-, 5-(Acetyloxy)-3-Ethenyldodecahydro-10,10B-Dihydroxy-3,4A,7,7,10A-Pentamethyl-1-Oxo-1H-Naphtho(2,1-B)Pyran-6-Yl Ester, (3R-(3Alpha,4Aabeta,5Beta,6Beta,6Aalpha,10Alpha,10Abeta,10Balpha))-
• Molecular Formula: C₃₄H₄₇IN₂O₁₀
• Molecular Weight: 770.66
• CAS Registry Number: 135159-46-5
• SMILES: [C@@]34(C)[C@]1(C(C[C@@](O[C@@]1([C@H]([C@@H](OC(NCCNC(CCC2=CC(=C(C=C2)O)[125I])=O)=O)[C@H]3C(CC[C@@H]4O)(C)C)OC(C)=O)C)(C=C)C)=O)O
• InChI: 1S/C34H47IN2O10/c1-8-31(5)18-24(41)34(44)32(6)23(40)13-14-30(3,4)27(32)26(28(45-19(2)38)33(34,7)47-31)46-29(43)37-16-15-36-25(42)12-10-20-9-11-22(39)21(35)17-20/h8-9,11,17,23,26-28,39-40,44H,1,10,12-16,18H2,2-7H3,(H,36,42)(H,37,43)/t23-,26-,27-,28-,31-,32-,33+,34-/m0/s1/i35-2
• InChIKey: LWLDYBWLIPVYGP-UZONJECRSA-N

Properties

• Density: 1.485g/cm³ (Cal.)