(1S,4aS,7aR)-4a-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methylcyclopenta[c]pyran-5(1H)-one
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![(1S,4aS,7aR)-4a-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methylcyclopenta[c]pyran-5(1H)-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4f797026afff4f61bf36275b001fc2ec.png "(1S,4aS,7aR)-4a-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methylcyclopenta[c]pyran-5(1H)-one")
(1S,4aS,7aR)-4a-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methylcyclopenta[c]pyran-5(1H)-one
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CAS No:
78280-92-9
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Formula:
C21H30O13
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Chemical Name:
(1S,4aS,7aR)-4a-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methylcyclopenta[c]pyran-5(1H)-one
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Synonyms:
Cyclopenta[c]pyran-5(1H)-one,4a-[(6-deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methyl-,(1S,4aS,7aR)-;Cyclopenta[c]pyran-5(1H)-one,4a-[(6-deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methyl-,[1S-(1α,4aα,7aα)]-;(1S,4aS,7aR)-4a-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methylcyclopenta[c]pyran-5(1H)-one;Teucardoside;NSC 348950
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CAS No:
(1S,4aS,7aR)-4a-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1-(β-D-glucopyranosyloxy)-4a,7a-dihydro-7-methylcyclopenta[c]pyran-5(1H)-one Basic Attributes
490.5 g/mol
490.46
348950
DTXSID60319645
Computed Properties
Molecular Weight:490.5
XLogP3:-3.4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:5
Exact Mass:490.16864101
Monoisotopic Mass:490.16864101
Topological Polar Surface Area:205
Heavy Atom Count:34
Complexity:832
Undefined Atom Stereocenter Count:13
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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