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Aquilarabietic Acid B
FEATURES
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NAMES
  • Aquilarabietic acid B
SMILES
CC(C)[C@@]1(O)C=C2[C@H](O)C[C@H]3[C@](C)(C(=O)O)CCC[C@]3(C)[C@H]2C[C@@H]1O
InChI
InChI=1S/C20H32O5/c1-11(2)20(25)10-12-13(8-16(20)22)18(3)6-5-7-19(4,17(23)24)15(18)9-14(12)21/h10-11,13-16,21-22,25H,5-9H2,1-4H3,(H,23,24)/t13-,14+,15+,16-,18+,19+,20-/m0/s1
MOLECULAR FORMULA
C20H32O5
CROSS REFERENCES
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Aquilarabietic Acid B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 352.22
AlogP 2.34
HBond donors 4
HBond acceptors 5
Atoms 57
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 Aquilarabietic Acid B.