Evernimicin
[CAS# 53024-98-9]

Identification

• Name: Evernimicin
• Synonyms: Everninomicin; Everninomycin
• Molecular Formula: C₇₀H₉₇Cl₂NO₃₈
• Molecular Weight: 1631.43
• CAS Registry Number: 53024-98-9
• SMILES: [C@@]19(OC%13(O[C@@H]1[C@H](O[C@@H](O[C@@H]8[C@@H](OC)[C@H](O[C@@H](OC7[C@H](O)C(OC)[C@H](O[C@@H]3OC[C@@H]2O[C@]5(O[C@H]2[C@H]3O)OC[C@@H](OC(=O)C4=C(O)C=C(O)C=C4C)[C@@H]6OCO[C@@H]56)O[C@@H]7COC)[C@@H]8O)C)[C@H]9O)C)O[C@@H]([C@@H](O[C@@H]%12O[C@@H]([C@@H](OC(=O)C%10=C(C(=C(O)C(=C%10OC)Cl)Cl)C)[C@H](O[C@H]%11O[C@H]([C@H](OC)[C@@]([N+]([O-])=O)(C%11)C)C)C%12)C)[C@H](O)C%13)C)C
• InChI: 1S/C70H97Cl2NO38/c1-24-15-31(74)16-32(75)40(24)61(82)100-36-22-94-70(60-53(36)92-23-93-60)108-37-21-91-63(46(79)52(37)109-70)106-65-56(89-13)45(78)51(35(101-65)20-86-10)104-64-47(80)55(50(87-11)27(4)97-64)105-66-57(81)68(9)59(30(7)98-66)110-69(111-68)18-33(76)48(28(5)107-69)102-38-17-34(99-39-19-67(8,73(84)85)58(90-14)29(6)96-39)49(26(3)95-38)103-62(83)41-25(2)42(71)44(77)43(72)54(41)88-12/h15-16,26-30,33-39,45-53,55-60,63-66,74-81H,17-23H2,1-14H3/t26-,27-,28-,29+,30-,33-,34-,35-,36-,37+,38+,39-,45+,46-,47-,48-,49-,50+,51?,52-,53+,55+,56?,57-,58+,59-,60-,63+,64+,65+,66+,67+,68-,69?,70-/m1/s1
• InChIKey: UPADRKHAIMTUCC-JBNGTWNESA-N

Properties

• Density: 1.56g/cm³ (Cal.)