beta-D-Galactopyranoside, (3beta,5alpha,22beta,25S)-spirosolan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)-
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beta-D-Galactopyranoside, (3beta,5alpha,22beta,25S)-spirosolan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)-
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CAS No:
85547-35-9
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Formula:
C51H85NO22
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Chemical Name:
beta-D-Galactopyranoside, (3beta,5alpha,22beta,25S)-spirosolan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)-
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Synonyms:
Neotomatine;85547-35-9;Sisunine;Tomatidine O-3-beta-commertetraoside;DTXSID901006107;beta-D-Galactopyranoside, (3beta,5alpha,22beta,25S)-spirosolan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)-;Spirosolan-3-yl hexopyranosyl-(1->2)-[hexopyranosyl-(1->3)]hexopyranosyl-(1->4)hexopyranoside
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CAS No:
beta-D-Galactopyranoside, (3beta,5alpha,22beta,25S)-spirosolan-3-yl O-beta-D-glucopyranosyl-(1-2)-O-(beta-D-glucopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)- Basic Attributes
1064.2 g/mol
1063.55632334 g/mol
Computed Properties
Molecular Weight:1064.2
XLogP3:-0.7
Hydrogen Bond Donor Count:14
Hydrogen Bond Acceptor Count:23
Rotatable Bond Count:12
Exact Mass:1063.55632334
Monoisotopic Mass:1063.55632334
Topological Polar Surface Area:358
Heavy Atom Count:74
Complexity:1900
Undefined Atom Stereocenter Count:32
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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