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Dehydrodaphnigraciline
FEATURES
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NAMES
  • Dehydrodaphnigraciline
SMILES
CCC1=CC[C@]2(CO1)[C@@H]1CCC3=C4[C@H](CC3)[C@H](C(=O)OC)C[C@]42CN(C)C1
InChI
InChI=1S/C23H33NO3/c1-4-17-9-10-22(14-27-17)16-7-5-15-6-8-18-19(21(25)26-3)11-23(22,20(15)18)13-24(2)12-16/h9,16,18-19H,4-8,10-14H2,1-3H3/t16-,18-,19-,22+,23+/m1/s1
MOLECULAR FORMULA
C23H33NO3
CROSS REFERENCES
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Dehydrodaphnigraciline

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 371.25
AlogP 3.93
HBond donors 0
HBond acceptors 4
Atoms 60
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 Dehydrodaphnigraciline.