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Cleistetroside-7
FEATURES
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NAMES
  • Cleistetroside-7
SMILES
CCCCCCCCCCCCO[C@@H]1O[C@@H](C)[C@H](O[C@@H]2O[C@@H](C)[C@H](OC(C)=O)[C@@H](O[C@@H]3O[C@@H](C)[C@H](OC(C)=O)[C@@H](O[C@@H]4O[C@@H](C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]4OC(C)=O)[C@H]3OC(C)=O)[C@H]2O)[C@@H](O)[C@H]1O
InChI
InChI=1S/C48H78O23/c1-12-13-14-15-16-17-18-19-20-21-22-58-45-34(56)33(55)36(23(2)59-45)69-46-35(57)40(37(24(3)60-46)63-27(6)49)70-47-44(68-32(11)54)42(39(26(5)61-47)65-29(8)51)71-48-43(67-31(10)53)41(66-30(9)52)38(25(4)62-48)64-28(7)50/h23-26,33-48,55-57H,12-22H2,1-11H3/t23-,24-,25-,26-,33-,34+,35+,36-,37-,38-,39-,40-,41+,42+,43+,44+,45+,46-,47-,48-/m0/s1
MOLECULAR FORMULA
C48H78O23
CROSS REFERENCES
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Cleistetroside-7

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 1022.49
AlogP 2.73
HBond donors 3
HBond acceptors 23
Atoms 149
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 Cleistetroside-7.