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108311-21-3 molecular structure
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(3S,4S,5R)-2-[hydroxy(13C)methyl]-5-(hydroxymethyl)oxolane-2,3,4-triol

ChemBase ID: 143233
Molecular Formular: C6H12O6
Molecular Mass: 181.14853484
Monoisotopic Mass: 181.06674294
SMILES and InChIs

SMILES:
C([C@@H]1[C@H]([C@@H](C(O1)([13CH2]O)O)O)O)O
Canonical SMILES:
OC[C@H]1OC([C@H]([C@@H]1O)O)(O)[13CH2]O
InChI:
InChI=1S/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2/t3-,4-,5+,6?/m1/s1/i2+1
InChIKey:
RFSUNEUAIZKAJO-BORCATHGSA-N

Cite this record

CBID:143233 http://www.chembase.cn/molecule-143233.html

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