sba

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 78
Total Number of Articles : 77
PubChem 167194468
Molecular Formula

C83H138N2O33

SMILES

C1CC(=O)N(C1=O)OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)C(C/C=C/CCCCCCCC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C83H138N2O33/c86-78-21-22-79(87)85(78)118-81(89)23-25-92-27-29-94-31-33-96-35-37-98-39-41-100-43-45-102-47-49-104-51-53-106-55-57-108-59-61-110-63-65-112-67-69-114-71-72-115-70-68-113-66-64-111-62-60-109-58-56-107-54-52-105-50-48-103-46-44-101-42-40-99-38-36-97-34-32-95-30-28-93-26-24-84-82(90)77(83(91)117-74-76-17-11-8-12-18-76)19-13-5-3-1-2-4-6-14-20-80(88)116-73-75-15-9-7-10-16-75/h5,7-13,15-18,77H,1-4,6,14,19-74H2,(H,84,90)/b13-5+

synonyms
  • SBA
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Properties
Property Value
MW 1692.0 g/mol
HBD 1
HBA 33
Rotatable Bond Count 95
Exact Mass 1690.9181848 g/mol
Monoisotopic Mass 1690.9181848 g/mol
Heavy Atom Count 118
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 2270
xlogp 1.6
Topological Polar Surface Area 367