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Raocyclamide A
FEATURES
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NAMES
  • RAOCYCLAMIDE A
SMILES
CC[C@H](C)[C@H]1NC(=O)c2coc(n2)[C@H](C)NC(=O)[C@H]2COC(=N2)[C@@H](Cc2ccccc2)NC(=O)c2csc1n2
InChI
InChI=1S/C27H30N6O5S/c1-4-14(2)21-27-32-20(13-39-27)24(36)29-17(10-16-8-6-5-7-9-16)26-31-18(12-38-26)22(34)28-15(3)25-30-19(11-37-25)23(35)33-21/h5-9,11,13-15,17-18,21H,4,10,12H2,1-3H3,(H,28,34)(H,29,36)(H,33,35)/t14-,15-,17+,18+,21+/m0/s1
MOLECULAR FORMULA
C27H30N6O5S
CROSS REFERENCES
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Raocyclamide A

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 550.20
AlogP 2.98
HBond donors 3
HBond acceptors 11
Atoms 69
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 Raocyclamide A.