6-[6-[[6-[4-[(E)-3-[(3-Amino-3-Iminopropyl)Amino]-3-Oxoprop-1-Enyl]Phenoxy]-5-(Diaminomethylideneamino)-4-Hydroxy-2-Methyloxan-3-Yl]Carbamoylamino]-5-(Carbamoylamino)-4-Hydroxyoxan-3-Yl]Oxy-7-Hydroxy-2-Oxo-3,3A,5,6,7,7alpha-Hexahydropyrano[2,3-d]Imidazole-1-Carboxamide
[CAS# 121634-35-3]

Identification

• Name: 6-[6-[[6-[4-[(E)-3-[(3-Amino-3-Iminopropyl)Amino]-3-Oxoprop-1-Enyl]Phenoxy]-5-(Diaminomethylideneamino)-4-Hydroxy-2-Methyloxan-3-Yl]Carbamoylamino]-5-(Carbamoylamino)-4-Hydroxyoxan-3-Yl]Oxy-7-Hydroxy-2-Oxo-3,3A,5,6,7,7alpha-Hexahydropyrano[2,3-d]Imidazole-1-Carboxamide
• Synonyms: 6-[6-[[6-[4-[(E)-3-[(3-Amino-3-Imino-Propyl)Amino]-3-Oxo-Prop-1-Enyl]Phenoxy]-5-Guanidino-4-Hydroxy-2-Methyl-Tetrahydropyran-3-Yl]Carbamoylamino]-4-Hydroxy-5-Ureido-Tetrahydropyran-3-Yl]Oxy-7-Hydroxy-2-Oxo-3,3A,5,6,7,7A-Hexahydropyrano[2,3-D]Imidazole-1-Carboxamide; 6-[[6-[[[[6-[4-[(E)-3-[(3-Amino-3-Iminopropyl)Amino]-3-Oxoprop-1-Enyl]Phenoxy]-5-Guanidino-4-Hydroxy-2-Methyl-3-Tetrahydropyranyl]Amino]-Oxomethyl]Amino]-4-Hydroxy-5-Ureido-3-Tetrahydropyranyl]Oxy]-7-Hydroxy-2-Oxo-3,3A,5,6,7,7A-Hexahydropyrano[2,3-D]Imidazole-1-Carboxamide; 6-[6-[[6-[4-[(E)-3-[(3-Amino-3-Imino-Propyl)Amino]-3-Keto-Prop-1-Enyl]Phenoxy]-5-Guanidino-4-Hydroxy-2-Methyl-Tetrahydropyran-3-Yl]Carbamoylamino]-4-Hydroxy-5-Ureido-Tetrahydropyran-3-Yl]Oxy-7-Hydroxy-2-Keto-3,3A,5,6,7,7A-Hexahydropyrano[2,3-D]Imidazole-1-Carboxamide
• Molecular Formula: C₃₃H₄₉N₁₃O₁₃
• Molecular Weight: 835.83
• CAS Registry Number: 121634-35-3
• SMILES: C5=C(OC4OC(C(NC(=O)NC3OCC(OC2C(O)C1N(C(=O)NC1OC2)C(=O)N)C(O)C3NC(=O)N)C(O)C4N=C(N)N)C)C=CC(=C5)\C=C\C(=O)NCCC(N)=N
• InChI: 1S/C33H49N13O13/c1-12-19(25(50)21(41-29(36)37)28(57-12)58-14-5-2-13(3-6-14)4-7-18(47)40-9-8-17(34)35)43-32(53)44-26-20(42-30(38)51)23(48)15(10-55-26)59-16-11-56-27-22(24(16)49)46(31(39)52)33(54)45-27/h2-7,12,15-16,19-28,48-50H,8-11H2,1H3,(H3,34,35)(H2,39,52)(H,40,47)(H,45,54)(H4,36,37,41)(H3,38,42,51)(H2,43,44,53)/b7-4+
• InChIKey: RALPRAPANVNIPH-QPJJXVBHSA-N

Properties

• Density: 1.863g/cm³ (Cal.)