1-[(2,3-Di-O-acetyl-6-deoxy-4-O-sulfohexopyranosyl)oxy]spirostan-3-yl acetate
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1-[(2,3-Di-O-acetyl-6-deoxy-4-O-sulfohexopyranosyl)oxy]spirostan-3-yl acetate
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CAS No:
151589-16-1
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Formula:
C39H60O14S
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Chemical Name:
1-[(2,3-Di-O-acetyl-6-deoxy-4-O-sulfohexopyranosyl)oxy]spirostan-3-yl acetate
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Synonyms:
1-O-(2',3'-diacetylfucopyranosyl-(4'-sulfate))-5-spirostan-1-ol 3-acetate;1-O-2AcFS-SSOA;151589-16-1;1-O-2AcFS-Ssoa;Brisbagenin fucoside-4-(hydrogen sulfate) triacetate;DTXSID60934296;1-O-(2',3'-Diacetylfucopyranosyl-(4'-sulfate))-5-spirostan-1-ol 3-acetate;1-[(2,3-Di-O-acetyl-6-deoxy-4-O-sulfohexopyranosyl)oxy]spirostan-3-yl acetate;beta-L-Galactopyranoside, (1beta,3beta,5alpha,25R)-3-(acetyloxy)spirostan-1-yl 6-deoxy-, 2,3-diacetate 4-(hydrogen sulfate)
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CAS No:
1-[(2,3-Di-O-acetyl-6-deoxy-4-O-sulfohexopyranosyl)oxy]spirostan-3-yl acetate Basic Attributes
785.0 g/mol
784.37037776 g/mol
Computed Properties
Molecular Weight:785.0
XLogP3:5.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:10
Exact Mass:784.37037776
Monoisotopic Mass:784.37037776
Topological Polar Surface Area:188
Heavy Atom Count:54
Complexity:1570
Defined Atom Stereocenter Count:15
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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