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Bacoside A1

Bacoside A1 structure

CAS No:
58798-94-0
Formula:
C40H64O12
Chemical Name:
Bacoside A1
Synonyms:
Bacoside A1;58798-94-0
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Bacoside A1 Basic Attributes

Molecular Weight：

736.9

Exact Mass：

736.439777

Characteristics

PSA：

177

Density：

1.33±0.1 g/cm3 (20 ºC 760 Torr)

Computed Properties

Molecular Weight:736.9
XLogP3:3.8
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:6
Exact Mass:736.43977747
Monoisotopic Mass:736.43977747
Topological Polar Surface Area:177
Heavy Atom Count:52
Complexity:1400
Undefined Atom Stereocenter Count:19
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes