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1-O-METHYLDIHYDROOHIOENSIN B
FEATURES
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NAMES
  • 1-O-Methyldihydroohioensin B
SMILES
COc1cc(OC)c2c3c1-c1c(O)cccc1[C@@H]1Oc4ccccc4[C@@H](C[C@@H]2O)[C@@H]31
InChI
InChI=1S/C25H22O5/c1-28-18-11-19(29-2)23-20-13(7-5-8-15(20)26)25-21-14(10-16(27)22(18)24(21)23)12-6-3-4-9-17(12)30-25/h3-9,11,14,16,21,25-27H,10H2,1-2H3/t14-,16+,21+,25+/m1/s1
MOLECULAR FORMULA
C25H22O5
CROSS REFERENCES
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1-O-METHYLDIHYDROOHIOENSIN B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 402.15
AlogP 4.83
HBond donors 2
HBond acceptors 5
Atoms 52
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 1-O-METHYLDIHYDROOHIOENSIN B.