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Rel-Callilongisin B
FEATURES
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NAMES
  • Rel-Callilongisin B
SMILES
C=C(C)[C@@H]1CCC2=C[C@](O)(C(C)C)CC[C@@]23OC(=O)CC[C@@]13C
InChI
InChI=1S/C20H30O3/c1-13(2)16-7-6-15-12-19(22,14(3)4)10-11-20(15)18(16,5)9-8-17(21)23-20/h12,14,16,22H,1,6-11H2,2-5H3/t16-,18-,19-,20+/m0/s1
MOLECULAR FORMULA
C20H30O3
CROSS REFERENCES
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Rel-Callilongisin B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 318.22
AlogP 4.16
HBond donors 1
HBond acceptors 3
Atoms 53
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 Rel-Callilongisin B.