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Genipin
FEATURES
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NAMES
  • Genipin
SMILES
COC(=O)C1=CO[C@@H](O)[C@@H]2C(CO)=CC[C@H]12
InChI
InChI=1S/C11H14O5/c1-15-10(13)8-5-16-11(14)9-6(4-12)2-3-7(8)9/h2,5,7,9,11-12,14H,3-4H2,1H3/t7-,9-,11-/m1/s1
MOLECULAR FORMULA
C11H14O5
CROSS REFERENCES
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Genipin

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 226.08
AlogP -0.05
HBond donors 2
HBond acceptors 5
Atoms 30
Contains toxicophore No
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Genipin.