Difference between revisions of "CPD-170"

Latest revision as of 20:15, 25 March 2018

Metabolite CPD-170

• smiles:
  • C(O)C1(C(O)C(O)C(O)C(O1)OCC4(C(O)C(O)C(O)C(OCC3(C(O)C(O)C(O)C(OC2(CO)(C(O)C(O)C(CO)O2))O3))O4))
• common name:
  • stachyose
• inchi key:
  • InChIKey=UQZIYBXSHAGNOE-XNSRJBNMSA-N
• molecular weight:
  • 666.583
• Synonym(s):
  • (2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
  • α-D-Galp-(1->6)-α-D-Galp-(1->6)-α-D-Glcp-(1->2)-β-D-Fruf

Reaction(s) known to consume the compound

• RXN-11501

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

• 2.4.1.67-RXN

External links

• CAS : 10094-58-3
• PUBCHEM:
  • 439531
• KEGG-GLYCAN : G00278
• HMDB : HMDB03553
• LIGAND-CPD:
  • C01613
• CHEMSPIDER:
  • 388624
• CHEBI:
  • 17164

{{#set: common name=(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol|α-D-Galp-(1->6)-α-D-Galp-(1->6)-α-D-Glcp-(1->2)-β-D-Fruf}}