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COCONUT Compound

d-glyceraldehyde 3-phosphate

CNP0265487.1 · C3H7O6P · View on COCONUT ↗

2D Structure

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Identifiers

Named-glyceraldehyde 3-phosphate
IUPAC Name[(2~{R})-2-hydroxy-3-oxo-propyl] dihydrogen phosphate
COCONUT IDCNP0265487.1
CAS591-57-1, 142-10-9
InChIKeyLXJXRIRHZLFYRP-VKHMYHEASA-N
InChIInChI=1S/C3H7O6P/c4-1-3(5)2-9-10(6,7)8/h1,3,5H,2H2,(H2,6,7,8)/t3-/m0/s1
SMILESO=C[C@H](O)COP(=O)(O)O

Properties

Molecular FormulaC3H7O6P
Molecular Weight170.06
Exact Mass169.99802
Log P (ALogP)-1.34
TPSA104.06
H-Bond Donors / Acceptors3 / 4
Rotatable Bonds4
Lipinski's Rule of 5 Violations0
QED Drug-likeness0.36
NP-likeness1.55

Classification

NP PathwayCarbohydrates
NP SuperclassSaccharides
NP ClassMonosaccharides
Chemical SuperclassOrganic oxygen compounds
Chemical ClassOrganooxygen compounds
Chemical SubclassCarbohydrates and carbohydrate conjugates

Reported in GR-MAPs Plants

Arabidopsis thaliana as “Arabidopsis thaliana” in COCONUT
Oryza sativa as “Oryza sativa” in COCONUT

References (6)

  1. 10.1007/s002530000420
  2. 10.1016/J.PHYTOCHEM.2005.03.009
  3. 10.1021/CB3004226
  4. 10.1074/JBC.M314195200
  5. 10.1128/JB.138.2.653-656.1979
  6. 10.1371/JOURNAL.PONE.0133899

Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063. COCONUT release 2026-10.