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Trichagmalin D
FEATURES
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NAMES
  • Trichagmalin D
SMILES
C/C=C(\C)C(=O)O[C@H]1[C@@]2(C)C[C@@]3(O)[C@](C)([C@H]4CC[C@]5(C)C(=C4[C@H](OC(C)=O)[C@@]13O)[C@@H](OC(C)=O)C(=O)O[C@H]5c1ccoc1)[C@H]2CC(=O)OC
InChI
InChI=1S/C36H44O13/c1-9-17(2)29(40)49-31-33(6)16-35(42)34(7,22(33)14-23(39)44-8)21-10-12-32(5)25(24(21)28(36(31,35)43)47-19(4)38)26(46-18(3)37)30(41)48-27(32)20-11-13-45-15-20/h9,11,13,15,21-22,26-28,31,42-43H,10,12,14,16H2,1-8H3/b17-9+/t21-,22-,26+,27-,28-,31-,32+,33-,34+,35+,36+/m0/s1
MOLECULAR FORMULA
C36H44O13
CROSS REFERENCES
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Trichagmalin D

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 684.28
AlogP 3.42
HBond donors 2
HBond acceptors 13
Atoms 93
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 Trichagmalin D.