4'-(3-Iodo-4-Azidobenzene Sulfonyl)Cymarin
[CAS# 93422-88-9]

Identification

• Name: 4'-(3-Iodo-4-Azidobenzene Sulfonyl)Cymarin
• Synonyms: [6-[[10-Formyl-5,14-Dihydroxy-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-2,3,4,6,7,8,9,11,12,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-1-Yl]Oxy]-4-Methoxy-2-Methyl-Tetrahydropyran-3-Yl] 4-Azido-3-Iodo-Benzenesulfonate; 4-Azido-3-Iodobenzenesulfonic Acid [6-
• Molecular Formula: C₃₆H₄₆IN₃O₁₁S
• Molecular Weight: 855.74
• CAS Registry Number: 93422-88-9
• SMILES: [N+](=NC7=CC=C([S](OC6C(OC)CC(OC5C4(C3C(C1(O)C(C(CC1)C2=CC(OC2)=O)(CC3)C)CCC4(O)CCC5)C=O)OC6C)(=O)=O)C=C7I)=[N-]
• InChI: 1S/C36H46IN3O11S/c1-20-32(51-52(45,46)22-6-7-27(39-40-38)26(37)16-22)28(47-3)17-31(49-20)50-29-5-4-11-34(43)13-9-25-24(35(29,34)19-41)8-12-33(2)23(10-14-36(25,33)44)21-15-30(42)48-18-21/h6-7,15-16,19-20,23-25,28-29,31-32,43-44H,4-5,8-14,17-18H2,1-3H3
• InChIKey: GPRFRWROIZDLOI-UHFFFAOYSA-N