[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate
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[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate
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CAS No:
1745-65-9
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Formula:
C12H24O17P2
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Chemical Name:
[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate
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Synonyms:
alpha,alpha-trehalose 6,6'-diphosphate;trehalose 6,6'-diphosphate;1745-65-9;Trehalose 6,6'-diphosphate;DTXSID20938518;alpha,alpha-Trehalose 6,6'-diphosphate;[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate;Trehalose, 6,6'-bis(dihydrogen phosphate);6-O-Phosphonohexopyranosyl 6-O-phosphonohexopyranoside
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CAS No:
[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(phosphonooxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl dihydrogen phosphate Basic Attributes
502.26 g/mol
502.04887329 g/mol
Computed Properties
Molecular Weight:502.26
XLogP3:-7.5
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:8
Exact Mass:502.04887329
Monoisotopic Mass:502.04887329
Topological Polar Surface Area:283
Heavy Atom Count:31
Complexity:624
Defined Atom Stereocenter Count:10
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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