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Xestosaprol I
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NAMES
  • Xestosaprol I
SMILES
C[C@@]12CC[C@@H](O)[C@@H]3COC(=C31)C(=O)c1cc3ccccc3cc12
InChI
InChI=1S/C20H18O3/c1-20-7-6-16(21)14-10-23-19(17(14)20)18(22)13-8-11-4-2-3-5-12(11)9-15(13)20/h2-5,8-9,14,16,21H,6-7,10H2,1H3/t14-,16+,20-/m0/s1
MOLECULAR FORMULA
C20H18O3
CROSS REFERENCES
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Xestosaprol I

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 306.13
AlogP 3.35
HBond donors 1
HBond acceptors 3
Atoms 41
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 Xestosaprol I.