CPRiL

Structure

Relationships

Total Number of functionally related protein(s) : 14
Total Number of Articles : 11

PubChem

72145

Molecular Formula

C26H32N2O8

SMILES

CCOC1=C(C(=C(C2=C1C(OC2=O)C3C4=C(C5=C(C=C4CCN3C)OCO5)OC)N)OCC)OCC

InChI

InChI=1S/C26H32N2O8/c1-6-31-23-17-16(18(27)24(32-7-2)25(23)33-8-3)26(29)36-21(17)19-15-13(9-10-28(19)4)11-14-20(22(15)30-5)35-12-34-14/h11,19,21H,6-10,12,27H2,1-5H3

synonyms

Tritoqualine
Hypostamine
Hypostamin

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Properties

Property	Value
MW	500.5 g/mol
HBD	1
HBA	10
Rotatable Bond Count	8
Exact Mass	500.21586598 g/mol
Monoisotopic Mass	500.21586598 g/mol
Heavy Atom Count	36
Isotope Atom Count	0
Atom Stereo Count	2
Covalent Unit Count	1
Complexity	772
xlogp	3.7
Topological Polar Surface Area	111

tritoqualine