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[14C]-ANIDULAFUNGIN
FEATURES
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NAMES
  • [14C]-ANIDULAFUNGIN
  • Anidulafungin
SMILES
CCCCCOc1ccc(-c2ccc(-c3ccc([14C](=O)N[C@H]4C[C@@H](O)[C@@H](O)NC(=O)[C@@H]5[C@@H](O)[C@@H](C)CN5C(=O)[C@H]([C@H](C)O)NC(=O)[C@H]([C@H](O)[C@@H](O)c5ccc(O)cc5)NC(=O)[C@@H]5C[C@@H](O)CN5C(=O)[C@H]([C@H](C)O)NC4=O)cc3)cc2)cc1
InChI
InChI=1S/C58H73N7O17/c1-5-6-7-24-82-40-22-18-35(19-23-40)33-10-8-32(9-11-33)34-12-14-37(15-13-34)51(74)59-41-26-43(70)54(77)63-56(79)47-48(71)29(2)27-65(47)58(81)45(31(4)67)61-55(78)46(50(73)49(72)36-16-20-38(68)21-17-36)62-53(76)42-25-39(69)28-64(42)57(80)44(30(3)66)60-52(41)75/h8-23,29-31,39,41-50,54,66-73,77H,5-7,24-28H2,1-4H3,(H,59,74)(H,60,75)(H,61,78)(H,62,76)(H,63,79)/t29-,30-,31-,39+,41-,42-,43+,44-,45-,46-,47-,48-,49-,50-,54+/m0/s1/i51+2
MOLECULAR FORMULA
C58H73N7O17
CROSS REFERENCES
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[14C]-ANIDULAFUNGIN

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 1141.51
AlogP -0.93
HBond donors 14
HBond acceptors 24
Atoms 155
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by [14C]-ANIDULAFUNGIN.