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Physalin I
FEATURES
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NAMES
  • PHYSALIN I
SMILES
CO[C@H]1C=C2C=C[C@@H]3[C@H](CC[C@]4(O)C(=O)O[C@@]5(C)[C@H]6C[C@](C)([C@H](C)C(=O)O6)[C@H]6[C@@]3(O)C(=O)O[C@@]654)[C@@]2(C)C(=O)C1
InChI
InChI=1S/C29H34O10/c1-13-20(31)37-19-12-24(13,2)21-28(35)17-7-6-14-10-15(36-5)11-18(30)25(14,3)16(17)8-9-27(34)22(32)38-26(19,4)29(21,27)39-23(28)33/h6-7,10,13,15-17,19,21,34-35H,8-9,11-12H2,1-5H3/t13-,15+,16+,17-,19-,21+,24-,25+,26+,27+,28-,29+/m1/s1
MOLECULAR FORMULA
C29H34O10
CROSS REFERENCES
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Physalin I

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 542.22
AlogP 1.16
HBond donors 2
HBond acceptors 10
Atoms 73
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 Physalin I.