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Paraherquamide
FEATURES
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NAMES
  • Paraherquamide
SMILES
CN1C(=O)[C@]23C[C@H]4C(C)(C)[C@@]5(C[C@@]41CN2CC[C@@]3(C)O)C(=O)Nc1cc2c(cc15)OC(C)(C)C=CO2
InChI
InChI=1S/C28H35N3O5/c1-23(2)8-10-35-18-12-17-16(11-19(18)36-23)27(21(32)29-17)14-26-15-31-9-7-25(5,34)28(31,22(33)30(26)6)13-20(26)24(27,3)4/h8,10-12,20,34H,7,9,13-15H2,1-6H3,(H,29,32)/t20-,25+,26+,27+,28-/m0/s1
MOLECULAR FORMULA
C28H35N3O5
CROSS REFERENCES
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Paraherquamide

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 493.26
AlogP 2.80
HBond donors 2
HBond acceptors 8
Atoms 71
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 Paraherquamide.