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Phlomistetraol B
FEATURES
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NAMES
  • Phlomistetraol B
SMILES
CC1(C)CC[C@]2(CC[C@@H]3C(=CC[C@H]4[C@@]3(C)CC[C@@H]3[C@]4(C)C[C@@H](O)[C@H](O)[C@@]3(C)CO)[C@H]2O)C1
InChI
InChI=1S/C28H46O4/c1-24(2)12-13-28(15-24)11-8-18-17(22(28)31)6-7-20-25(18,3)10-9-21-26(20,4)14-19(30)23(32)27(21,5)16-29/h6,18-23,29-32H,7-16H2,1-5H3/t18-,19-,20+,21-,22-,23+,25+,26-,27+,28-/m1/s1
MOLECULAR FORMULA
C28H46O4
CROSS REFERENCES
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Phlomistetraol B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 446.34
AlogP 4.45
HBond donors 4
HBond acceptors 4
Atoms 78
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 Phlomistetraol B.