Difference between revisions of "CPD-1099"

Latest revision as of 16:29, 21 June 2019

Metabolite CPD-1099

• smiles:
  • C(OC1(C(C(C(C(CO)O1)O)O)O))C2(C(C(C(C(O2)OC3(CO)(C(C(C(CO)O3)O)O))O)O)O)
• common name:
  • raffinose
• molecular weight:
  • 504.441
• inchi key:
  • InChIKey=MUPFEKGTMRGPLJ-ZQSKZDJDSA-N
• Synonym(s):
  • melitose
  • melitriose
  • gossypose
  • 6G-α-D-galactosylsucrose
  • (2S,3R,4S,5S,6R)-2-[[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
  • α-D-Galp-(1->6)-α-D-Glcp-(1->2)-β-D-Fruf
  • α-D-galactopyranosyl-(1->6)-α-D-glucopyranosyl-(1->2)-β-D-fructofuranoside
  • D-raffinose

Reaction(s) known to consume the compound

• RXN-11502

Reaction(s) known to produce the compound

• 2.4.1.82-RXN
• RXN-11501

Reaction(s) of unknown directionality

• 2.4.1.67-RXN

External links

• KEGG-GLYCAN : G00249
• CAS : 512-69-6
• METABOLIGHTS : MTBLC16634
• HMDB : HMDB03213
• LIGAND-CPD:
  • C00492
• CHEMSPIDER:
  • 388379
• PUBCHEM:
  • 439242
• CHEBI:
  • 16634
• REFMET : Raffinose

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