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Correloid
FEATURES
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NAMES
  • Correloid
SMILES
C=C1C[C@@]2(O)C3CC[C@]4(C)C([C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]5([C@@H](C)OC(C)=O)COC(=O)C=CC45)[C@@]3(C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@]2(C)C2(C(=O)OC)O[C@H]12
InChI
InChI=1S/C40H52O16/c1-18-16-39(48)26-14-15-35(8)25-12-13-27(46)50-17-38(25,19(2)51-20(3)41)31(53-22(5)43)28(52-21(4)42)29(35)36(26,9)32(54-23(6)44)33(55-24(7)45)37(39,10)40(30(18)56-40)34(47)49-11/h12-13,19,25-26,28-33,48H,1,14-17H2,2-11H3/t19-,25?,26?,28+,29?,30-,31+,32-,33+,35+,36+,37-,38-,39-,40?/m1/s1
MOLECULAR FORMULA
C40H52O16
CROSS REFERENCES
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Correloid

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 788.33
AlogP 2.45
HBond donors 1
HBond acceptors 16
Atoms 108
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 Correloid.