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SCHISANDRIN A1
FEATURES
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NAMES
  • schisandrin A1
SMILES
COc1cc2c(c(OC)c1OC)-c1c(cc3c(c1OC)OCO3)C[C@H](C)[C@]1(CO1)[C@H]2OC(=O)c1ccccc1
InChI
InChI=1S/C30H30O9/c1-16-11-18-12-21-25(37-15-36-21)26(34-4)22(18)23-19(13-20(32-2)24(33-3)27(23)35-5)28(30(16)14-38-30)39-29(31)17-9-7-6-8-10-17/h6-10,12-13,16,28H,11,14-15H2,1-5H3/t16-,28-,30+/m0/s1
MOLECULAR FORMULA
C30H30O9
CROSS REFERENCES
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SCHISANDRIN A1

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 534.19
AlogP 4.98
HBond donors 0
HBond acceptors 9
Atoms 69
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by SCHISANDRIN A1.