avrainvillamide

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 4
Total Number of Articles : 3
PubChem 163285907
Molecular Formula

C26H27N3O4

SMILES

CC1(C=CC2=C(O1)C=CC3=C2[N+](=C4C3=CC56C(C4(C)C)C[C@]7(CCCN7C5=O)C(=O)N6)[O-])C

InChI

InChI=1S/C26H27N3O4/c1-23(2)10-8-15-17(33-23)7-6-14-16-12-26-18(24(3,4)20(16)29(32)19(14)15)13-25(21(30)27-26)9-5-11-28(25)22(26)31/h6-8,10,12,18H,5,9,11,13H2,1-4H3,(H,27,30)/t18?,25-,26?/m1/s1

synonyms
  • Avrainvillamide
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Properties
Property Value
MW 445.5 g/mol
HBD 1
HBA 4
Rotatable Bond Count 0
Exact Mass 445.20015635 g/mol
Monoisotopic Mass 445.20015635 g/mol
Heavy Atom Count 33
Isotope Atom Count 0
Atom Stereo Count 3
Covalent Unit Count 1
Complexity 1100
xlogp 2.1
Topological Polar Surface Area 87.4