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Psammaplysin T
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NAMES
  • Psammaplysin T
SMILES
CCC(C)CCCCCCCCCCCCCCC(=O)NCCc1cc(Br)c(OCCCNC(=O)C2=NO[C@@]3(CC(Br)=C(OC)C(Br)=CO3)[C@H]2O)c(Br)c1
InChI
InChI=1S/C40H59Br4N3O7/c1-4-28(2)18-15-13-11-9-7-5-6-8-10-12-14-16-19-34(48)45-22-20-29-24-30(41)37(31(42)25-29)52-23-17-21-46-39(50)35-38(49)40(54-47-35)26-32(43)36(51-3)33(44)27-53-40/h24-25,27-28,38,49H,4-23,26H2,1-3H3,(H,45,48)(H,46,50)/t28?,38-,40-/m0/s1
MOLECULAR FORMULA
C40H59Br4N3O7
CROSS REFERENCES
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Psammaplysin T

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 1009.11
AlogP 10.62
HBond donors 3
HBond acceptors 10
Atoms 113
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 Psammaplysin T.