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Stypohydroperoxide
FEATURES
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NAMES
  • Stypohydroperoxide
SMILES
COC1=CC(C)=C2O[C@@]3(CC2(OO)C1=O)[C@@H](O)CC[C@@H]1[C@@]2(C)CC[C@H](O)C(C)(C)[C@@H]2CC[C@]13C
InChI
InChI=1S/C27H40O7/c1-15-13-16(32-6)21(30)26(34-31)14-27(33-22(15)26)20(29)8-7-18-24(4)11-10-19(28)23(2,3)17(24)9-12-25(18,27)5/h13,17-20,28-29,31H,7-12,14H2,1-6H3/t17-,18+,19-,20-,24-,25+,26?,27-/m0/s1
MOLECULAR FORMULA
C27H40O7
CROSS REFERENCES
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Stypohydroperoxide

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 476.28
AlogP 4.14
HBond donors 3
HBond acceptors 7
Atoms 74
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 Stypohydroperoxide.