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(17R,18R,21R,22S)-reticulation-1
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NAMES
  • (17R,18R,21R,22S)-reticulation-1
SMILES
CCCCCCCCCCCC[C@H](O)[C@H]1CC[C@H]([C@H](O)CCCCCCCCCCCCCCC2=C[C@H](C)OC2=O)O1
InChI
InChI=1S/C37H68O5/c1-3-4-5-6-7-8-14-17-20-23-26-33(38)35-28-29-36(42-35)34(39)27-24-21-18-15-12-10-9-11-13-16-19-22-25-32-30-31(2)41-37(32)40/h30-31,33-36,38-39H,3-29H2,1-2H3/t31-,33-,34+,35+,36+/m0/s1
MOLECULAR FORMULA
C37H68O5
CROSS REFERENCES
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(17R,18R,21R,22S)-reticulation-1

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 592.51
AlogP 9.90
HBond donors 2
HBond acceptors 5
Atoms 110
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 (17R,18R,21R,22S)-reticulation-1.