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Rediocide B
FEATURES
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NAMES
  • Rediocide B
SMILES
CC(C)CC(=O)O[C@H]1/C=C/C=C/C(=O)O[C@H]2[C@@H](C)C[C@@H]3[C@]2(O)[C@H](O)[C@@]2(CO)O[C@H]2[C@H]2[C@H]4OC5(c6ccccc6)O[C@@H]([C@@H](C)[C@@]23O5)[C@@]4(O)[C@](C)(O)CC2CCC1CC2
InChI
InChI=1S/C44H58O13/c1-23(2)19-32(47)52-29-13-9-10-14-31(46)53-34-24(3)20-30-41(34,50)38(48)40(22-45)36(54-40)33-37-43(51,39(5,49)21-26-15-17-27(29)18-16-26)35-25(4)42(30,33)57-44(55-35,56-37)28-11-7-6-8-12-28/h6-14,23-27,29-30,33-38,45,48-51H,15-22H2,1-5H3/b13-9+,14-10+/t24-,25+,26?,27?,29-,30+,33-,34-,35-,36-,37+,38+,39+,40-,41+,42-,43-,44?/m0/s1
MOLECULAR FORMULA
C44H58O13
CROSS REFERENCES
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Rediocide B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 794.39
AlogP 3.18
HBond donors 5
HBond acceptors 13
Atoms 115
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Rediocide B.