ChEBI
  Mrv0541 02241222312D          

 13 12  0  0  0  0            999 V2000
    8.7214   -4.8742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7214   -5.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7214   -6.5242    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.7214   -7.3492    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.7214   -8.1742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4359   -8.5867    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4364   -4.4562    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8964   -5.6992    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5464   -5.6992    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8964   -6.5242    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5464   -6.5242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8964   -7.3492    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5464   -7.3492    0.0000 O   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>
YMDB00661

> <DATABASE_NAME>
YMDB

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

> <INCHI_IDENTIFIER>
InChI=1S/C5H10O4/c6-2-1-4(8)5(9)3-7/h2,4-5,7-9H,1,3H2/t4-,5+/m0/s1

> <INCHI_KEY>
ASJSAQIRZKANQN-CRCLSJGQSA-N

> <FORMULA>
C5H10O4

> <MOLECULAR_WEIGHT>
134.1305

> <EXACT_MASS>
134.057908808

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
12.7114814509769

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

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

> <ALOGPS_LOGP>
-1.90

> <JCHEM_LOGP>
-2.222867160333333

> <ALOGPS_LOGS>
0.72

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
13.421911653562585

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.596483314248868

> <JCHEM_PKA_STRONGEST_BASIC>
-2.9723451301813055

> <JCHEM_POLAR_SURFACE_AREA>
77.76

> <JCHEM_REFRACTIVITY>
30.044899999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
7.09e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
deoxyribose

> <JCHEM_VEBER_RULE>
0

> <YMDB_ID>
YMDB00661

> <GENERIC_NAME>
2-deoxy-D-ribose

> <SYNONYMS>
2-Deoxy-alpha-D-ribose 1-phosphate; 2-Deoxy-D-arabinose; 2-Deoxy-D-erythro-pentose; 2-Deoxy-D-ribohexopyranose; 2-Deoxy-D-ribose; 2-Deoxy-D-ribose 1-phosphate; 2-Deoxypentose; 2-Deoxyribose; 2-Desoxy ribosoe; 2'-Deoxy-D-ribose; D-2-Deoxyribose; D-2-Desoxyribose; D-dRib; D-Erythro-Pentose, 2-deoxy-; D-Ribose, 2-deoxy-; deoxy-ribose 1-phosphate; Deoxyribose; Ribose, 2-deoxy-, D-; Thyminose

$$$$