Difference between revisions of "KDO-LIPID-IVA"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=TDP TDP] == * smiles: ** CC1(=CN(C(=O)NC(=O)1)C2(CC(O)C(COP(=O)([O-])OP(=O)([O-])[O-])O2)) * co...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=KDO-LIPID-IVA KDO-LIPID-IVA] == * smiles: ** CCCCCCCCCCCC(O)CC(=O)NC1(C(OP([O-])([O-])=O)OC(C(O...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=TDP TDP] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=KDO-LIPID-IVA KDO-LIPID-IVA] ==
 
* smiles:
 
* smiles:
−
** CC1(=CN(C(=O)NC(=O)1)C2(CC(O)C(COP(=O)([O-])OP(=O)([O-])[O-])O2))
+
** CCCCCCCCCCCC(O)CC(=O)NC1(C(OP([O-])([O-])=O)OC(C(O)C(OC(CC(O)CCCCCCCCCCC)=O)1)COC2(C(NC(CC(O)CCCCCCCCCCC)=O)C(OC(CC(O)CCCCCCCCCCC)=O)C(C(O2)COC3(C([O-])=O)(O[CH](C(CO)O)C(O)C(O)C3))OP([O-])([O-])=O))
 
* common name:
 
* common name:
−
** dTDP
+
** α-Kdo-(2→6)-lipid IVA
 
* inchi key:
 
* inchi key:
−
** InChIKey=UJLXYODCHAELLY-XLPZGREQSA-K
+
** InChIKey=GPNCBCJEDRRCDW-XFULRARUSA-I
 
* molecular weight:
 
* molecular weight:
−
** 399.167    
+
** 1620.861    
 
* Synonym(s):
 
* Synonym(s):
−
** TDP
+
** 3-Deoxy-D-manno-octulosonyl-lipid IV(A)
−
** thymidine 5'-(trihydrogen diphosphate) (9CI)
+
** 3-deoxy-α-D-manno-oct-2-ulopyranosyl-(2->6)-2-deoxy-2-{[(3R)-3-hydroxypentadecanoyl]amino}-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O-phosphono-β-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-{[(3R)-3-hydroxytetradecanoyl]amino}-1-O-phosphono-α-D-glucopyranose
−
** deoxy-TDP
+
** (KDO)-lipid IVA
−
** thymidine-5'-diphosphate
+
−
** thymidine-diphosphate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-14213]]
+
* [[KDOTRANS2-RXN]]
−
* [[DTDPKIN-RXN]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[DTMPKI-RXN]]
+
* [[KDOTRANS-RXN]]
−
* [[THYMIDINE-TRIPHOSPHATASE-RXN]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* CAS : 491-97-4
 
−
* BIGG : dtdp
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21124327 21124327]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91820572 91820572]
−
* HMDB : HMDB01274
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00363 C00363]
+
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.19989845.html 19989845]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58369 58369]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=60364 60364]
−
* METABOLIGHTS : MTBLC58369
+
* BIGG : kdolipid4
−
{{#set: smiles=CC1(=CN(C(=O)NC(=O)1)C2(CC(O)C(COP(=O)([O-])OP(=O)([O-])[O-])O2))}}
+
* LIGAND-CPD:
−
{{#set: common name=dTDP}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C06024 C06024]
−
{{#set: inchi key=InChIKey=UJLXYODCHAELLY-XLPZGREQSA-K}}
+
{{#set: smiles=CCCCCCCCCCCC(O)CC(=O)NC1(C(OP([O-])([O-])=O)OC(C(O)C(OC(CC(O)CCCCCCCCCCC)=O)1)COC2(C(NC(CC(O)CCCCCCCCCCC)=O)C(OC(CC(O)CCCCCCCCCCC)=O)C(C(O2)COC3(C([O-])=O)(O[CH](C(CO)O)C(O)C(O)C3))OP([O-])([O-])=O))}}
−
{{#set: molecular weight=399.167   }}
+
{{#set: common name=α-Kdo-(2→6)-lipid IVA}}
−
{{#set: common name=TDP|thymidine 5'-(trihydrogen diphosphate) (9CI)|deoxy-TDP|thymidine-5'-diphosphate|thymidine-diphosphate}}
+
{{#set: inchi key=InChIKey=GPNCBCJEDRRCDW-XFULRARUSA-I}}
−
{{#set: consumed by=RXN-14213|DTDPKIN-RXN}}
+
{{#set: molecular weight=1620.861   }}
−
{{#set: produced by=DTMPKI-RXN|THYMIDINE-TRIPHOSPHATASE-RXN}}
+
{{#set: common name=3-Deoxy-D-manno-octulosonyl-lipid IV(A)|3-deoxy-α-D-manno-oct-2-ulopyranosyl-(2->6)-2-deoxy-2-{[(3R)-3-hydroxypentadecanoyl]amino}-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O-phosphono-β-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-{[(3R)-3-hydroxytetradecanoyl]amino}-1-O-phosphono-α-D-glucopyranose|(KDO)-lipid IVA}}
 +
{{#set: consumed by=KDOTRANS2-RXN}}
 +
{{#set: produced by=KDOTRANS-RXN}}

Latest revision as of 20:15, 21 March 2018

Metabolite KDO-LIPID-IVA

  • smiles:
    • CCCCCCCCCCCC(O)CC(=O)NC1(C(OP([O-])([O-])=O)OC(C(O)C(OC(CC(O)CCCCCCCCCCC)=O)1)COC2(C(NC(CC(O)CCCCCCCCCCC)=O)C(OC(CC(O)CCCCCCCCCCC)=O)C(C(O2)COC3(C([O-])=O)(O[CH](C(CO)O)C(O)C(O)C3))OP([O-])([O-])=O))
  • common name:
    • α-Kdo-(2→6)-lipid IVA
  • inchi key:
    • InChIKey=GPNCBCJEDRRCDW-XFULRARUSA-I
  • molecular weight:
    • 1620.861
  • Synonym(s):
    • 3-Deoxy-D-manno-octulosonyl-lipid IV(A)
    • 3-deoxy-α-D-manno-oct-2-ulopyranosyl-(2->6)-2-deoxy-2-{[(3R)-3-hydroxypentadecanoyl]amino}-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O-phosphono-β-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-{[(3R)-3-hydroxytetradecanoyl]amino}-1-O-phosphono-α-D-glucopyranose
    • (KDO)-lipid IVA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCCCCC(O)CC(=O)NC1(C(OP([O-])([O-])=O)OC(C(O)C(OC(CC(O)CCCCCCCCCCC)=O)1)COC2(C(NC(CC(O)CCCCCCCCCCC)=O)C(OC(CC(O)CCCCCCCCCCC)=O)C(C(O2)COC3(C([O-])=O)(O[CH](C(CO)O)C(O)C(O)C3))OP([O-])([O-])=O))" cannot be used as a page name in this wiki.


"3-deoxy-α-D-manno-oct-2-ulopyranosyl-(2->6)-2-deoxy-2-{[(3R)-3-hydroxypentadecanoyl]amino}-3-O-[(3R)-3-hydroxytetradecanoyl]-4-O-phosphono-β-D-glucopyranosyl-(1->6)-2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-{[(3R)-3-hydroxytetradecanoyl]amino}-1-O-phosphono-α-D-glucopyranose" cannot be used as a page name in this wiki.


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