ChEBI
  Mrv0541 02241222372D          

 13 12  0  0  1  0            999 V2000
    7.7864   -3.9313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7864   -4.7563    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.7864   -5.5813    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.7864   -6.4063    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.7864   -7.2313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5009   -7.6438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5014   -3.5133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9614   -4.7563    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6114   -4.7563    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9614   -5.5813    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6114   -5.5813    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9614   -6.4063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6114   -6.4063    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  1  2  0  0  0  0
  2  8  1  1  0  0  0
  2  9  1  1  0  0  0
  3 10  1  1  0  0  0
  3 11  1  1  0  0  0
  4 12  1  1  0  0  0
  4 13  1  1  0  0  0
M  END
> <DATABASE_ID>
YMDB00821

> <DATABASE_NAME>
YMDB

> <SMILES>
[H][C@](O)(CO)[C@@]([H])(O)[C@]([H])(O)C=O

> <INCHI_IDENTIFIER>
InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4+,5+/m1/s1

> <INCHI_KEY>
PYMYPHUHKUWMLA-WISUUJSJSA-N

> <FORMULA>
C5H10O5

> <MOLECULAR_WEIGHT>
150.1299

> <EXACT_MASS>
150.05282343

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_AVERAGE_POLARIZABILITY>
13.395282072020564

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S,3R,4S)-2,3,4,5-tetrahydroxypentanal

> <ALOGPS_LOGP>
-2.28

> <JCHEM_LOGP>
-2.9380256209999995

> <ALOGPS_LOGS>
0.40

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.05193577352083

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.871096474968176

> <JCHEM_PKA_STRONGEST_BASIC>
-2.9744929158468105

> <JCHEM_POLAR_SURFACE_AREA>
97.99000000000001

> <JCHEM_REFRACTIVITY>
31.383099999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
3.80e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
L(+)-xylose

> <JCHEM_VEBER_RULE>
0

> <YMDB_ID>
YMDB00821

> <GENERIC_NAME>
aldehydo-L-Xylose

> <SYNONYMS>
aldehydo-L-xylose; L-Xyl; L-xylo-pentose; L-Xylose; L(+)-Xylose

$$$$