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Athrolide B
FEATURES
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NAMES
  • Athrolide B
SMILES
C=C1C(=O)O[C@H]2C[C@@H](C)[C@@H]3[C@@H](OC(=O)C(C)C)C[C@@H](OC(C)=O)[C@@]3(C)[C@H](O)[C@H]12
InChI
InChI=1S/C21H30O7/c1-9(2)19(24)28-14-8-15(26-12(5)22)21(6)17(14)10(3)7-13-16(18(21)23)11(4)20(25)27-13/h9-10,13-18,23H,4,7-8H2,1-3,5-6H3/t10-,13+,14+,15-,16-,17-,18-,21-/m1/s1
MOLECULAR FORMULA
C21H30O7
CROSS REFERENCES
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Athrolide B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 394.20
AlogP 2.01
HBond donors 1
HBond acceptors 7
Atoms 58
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 Athrolide B.