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CEPHALOSTATIN 19
FEATURES
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NAMES
  • Cephalostatin 19
SMILES
CO[C@H]1c2nc3c(nc2C[C@@H]2CC[C@H]4C5=CC[C@@H]6[C@H](C)[C@@]7(OC[C@]56C(=O)C[C@@H]4[C@]21C)OC(C)(C)C[C@H]7O)C[C@@]1(C)[C@@H](CC[C@H]2C4=C[C@@H]5O[C@]6(O[C@](C)(CO)C[C@H]6O)[C@@H](C)[C@]5(O)[C@@]4(C)[C@H](O)C[C@@H]21)C3
InChI
InChI=1S/C55H76N2O11/c1-26-32-14-15-33-30-13-11-29-17-38-45(46(64-9)50(29,7)35(30)19-41(60)52(32,33)25-65-54(26)42(61)22-47(3,4)67-54)57-37-16-28-10-12-31-34(49(28,6)21-39(37)56-38)18-40(59)51(8)36(31)20-44-53(51,63)27(2)55(66-44)43(62)23-48(5,24-58)68-55/h15,20,26-32,34-35,40,42-44,46,58-59,61-63H,10-14,16-19,21-25H2,1-9H3/t26-,27-,28-,29-,30-,31+,32+,34-,35-,40+,42+,43+,44-,46-,48-,49-,50-,51+,52+,53+,54+,55-/m0/s1
MOLECULAR FORMULA
C55H76N2O11
CROSS REFERENCES
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CEPHALOSTATIN 19

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 940.54
AlogP 5.65
HBond donors 5
HBond acceptors 13
Atoms 144
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 CEPHALOSTATIN 19.