D-Mannoketoheptose

CAS	3615-44-9
Structure
Synonyms	D-Manno-2-heptulose
IUPAC Name	(3S,4S,5R,6R)-1,3,4,5,6,7-hexahydroxyheptan-2-one
Molecular Weight	210.18
Molecular Formula	C7H14O7
Canonical SMILES	C([C@H]([C@H]([C@@H]([C@@H](C(=O)CO)O)O)O)O)O
InChI	InChI=1S/C7H14O7/c8-1-3(10)5(12)7(14)6(13)4(11)2-9/h3,5-10,12-14H,1-2H2/t3-,5-,6-,7+/m1/s1
InChI Key	HSNZZMHEPUFJNZ-QMTIVRBISA-N
Boiling Point	628.0±55.0 °C
Melting Point	148-150 °C
Purity	98%
Density	1.645±0.06 g/ml
pKa	11.86±0.20
Solubility in Water	Sligthly
Appearance	White to off-white solid