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Aigialospirol
FEATURES
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NAMES
  • Aigialospirol
SMILES
COc1cc(O)c2c(c1)[C@@H]([C@H]1C[C@H](O)[C@H](O)[C@@]3(C=CC[C@H](C)O3)O1)OC2=O
InChI
InChI=1S/C19H22O8/c1-9-4-3-5-19(26-9)17(22)13(21)8-14(27-19)16-11-6-10(24-2)7-12(20)15(11)18(23)25-16/h3,5-7,9,13-14,16-17,20-22H,4,8H2,1-2H3/t9-,13-,14+,16-,17-,19+/m0/s1
MOLECULAR FORMULA
C19H22O8
CROSS REFERENCES
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Aigialospirol

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 378.13
AlogP 1.18
HBond donors 3
HBond acceptors 8
Atoms 49
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 Aigialospirol.