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Spirolide C
FEATURES
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NAMES
  • spirolide C
SMILES
C=C1CCCC2=NC[C@H](C)[C@@H](C)C[C@@]23CCC([C@@H]2C=C(C)C(=O)O2)=C(C)[C@@H]3/C=C(\C)[C@@H](O)C[C@H]2O[C@]3(CC[C@@]4(O[C@@H](CC[C@@]4(C)O)C1)O3)C[C@H]2C
InChI
InChI=1S/C43H63NO7/c1-25-10-9-11-38-41(22-28(4)30(6)24-44-38)15-13-33(37-20-27(3)39(46)48-37)31(7)34(41)19-26(2)35(45)21-36-29(5)23-42(50-36)16-17-43(51-42)40(8,47)14-12-32(18-25)49-43/h19-20,28-30,32,34-37,45,47H,1,9-18,21-24H2,2-8H3/b26-19+/t28-,29+,30-,32-,34-,35-,36+,37-,40+,41+,42-,43+/m0/s1
MOLECULAR FORMULA
C43H63NO7
CROSS REFERENCES
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Spirolide C

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 705.46
AlogP 8.07
HBond donors 2
HBond acceptors 8
Atoms 114
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 Spirolide C.