Monazomycin
[CAS# 11006-31-8]

Identification

• Name: Monazomycin
• Synonyms: 48-(8-Aminooctan-2-Yl)-8,10,16,20,24,26,28,32,36,38,40,42,44,46-Tetradecahydroxy-9,15,17,19,21,25,31,33,39,41,47-Undecamethyl-23-[(2S,3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-1-Oxacyclooctatetraconta-13,17,21,29-Tetraen-2-One; 48-(7-Amino-1-Methyl-Heptyl)-8,10,16,20,24,26,28,32,36,38,40,42,44,46-Tetradecahydroxy-9,15,17,19,21,25,31,33,39,41,47-Undecamethyl-23-[(2S,3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-1-Oxacyclooctatetraconta-13,17,21,29-Tetraen-2-One; (13E,17E,21E,29Z)-48-(7-Amino-1-Methyl-Heptyl)-8,10,16,20,24,26,28,32,36,38,40,42,44,46-Tetradecahydroxy-9,15,17,19,21,25,31,33,39,41,47-Undecamethyl-23-[(2S,3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-1-Oxacyclooctatetraconta-13,17,21,29-Tetraen-2-One
• Molecular Formula: C₇₂H₁₃₃NO₂₂
• Molecular Weight: 1364.84
• CAS Registry Number: 11006-31-8
• SMILES: [C@H]2(OC\1C(O)C(C(O)CC(O)\C=C/C(C(O)C(CCC(O)CC(O)C(C(O)C(C(O)CC(O)CC(O)C(C(OC(=O)CCCCCC(O)C(C(O)CC\C=C/C(C(O)C(=C/C(C(O)C(=C1)\C)C)\C)C)C)C(CCCCCCN)C)C)C)C)C)C)C)O[C@@H]([C@@H](O)[C@H](O)[C@@H]2O)CO
• InChI: 1S/C72H133NO22/c1-39-22-19-20-25-55(79)46(8)54(78)24-17-15-18-26-62(84)95-71(42(4)23-16-13-14-21-31-73)50(12)59(83)37-53(77)36-58(82)48(10)66(88)47(9)56(80)34-51(75)29-27-40(2)63(85)41(3)28-30-52(76)35-57(81)49(11)67(89)60(33-45(7)65(87)44(6)32-43(5)64(39)86)93-72-70(92)69(91)68(90)61(38-74)94-72/h19,22,28,30,32-33,39-42,44,46-61,63-72,74-83,85-92H,13-18,20-21,23-27,29,31,34-38,73H2,1-12H3/b22-19-,30-28-,43-32-,45-33-/t39?,40?,41?,42?,44?,46?,47?,48?,49?,50?,51?,52?,53?,54?,55?,56?,57?,58?,59?,60?,61-,63?,64?,65?,66?,67?,68-,69+,70+,71?,72+/m1/s1
• InChIKey: BTUZNIQVZBANAX-SWQYCTROSA-N

Properties

• Density: 1.229g/cm³ (Cal.)
• Boiling point: 1327.127°C at 760 mmHg (Cal.)
• Flash point: 756.419°C (Cal.)