Difference between revisions of "LIPID-IV-A"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8892 CPD-8892] == * smiles: ** CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-]) * inchi key: **...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LIPID-IV-A LIPID-IV-A] == * smiles: ** CCCCCCCCCCCC(O)CC(=O)NC1(C(OP([O-])([O-])=O)OC(C(O)C(OC(...")
 
(3 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8892 CPD-8892] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LIPID-IV-A LIPID-IV-A] ==
 
* smiles:
 
* smiles:
−
** CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-])
+
** 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)CO)OP([O-])([O-])=O))
−
* inchi key:
+
−
** InChIKey=UFPQIRYSPUYQHK-XWYPZHSRSA-M
+
 
* common name:
 
* common name:
−
** leukotriene A4
+
** lipid IVA
 +
* inchi key:
 +
** InChIKey=KVJWZTLXIROHIL-QDORLFPLSA-J
 
* molecular weight:
 
* molecular weight:
−
** 317.447    
+
** 1401.69    
 
* Synonym(s):
 
* Synonym(s):
−
** leukotriene A(4)
+
** 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
−
** (7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate
+
−
** LTA4
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[LEUKOTRIENE-A4-HYDROLASE-RXN]]
+
* [[KDOTRANS-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[TETRAACYLDISACC4KIN-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* CAS : 72059-45-1
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91819769 91819769]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10329123 10329123]
−
* HMDB : HMDB01337
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00909 C00909]
+
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.20117934.html 20117934]
+
** [http://www.chemspider.com/Chemical-Structure.8504584.html 8504584]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57463 57463]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58603 58603]
−
* METABOLIGHTS : MTBLC57463
+
* BIGG : lipidA
−
{{#set: smiles=CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-])}}
+
* LIGAND-CPD:
−
{{#set: inchi key=InChIKey=UFPQIRYSPUYQHK-XWYPZHSRSA-M}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C04919 C04919]
−
{{#set: common name=leukotriene A4}}
+
{{#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)CO)OP([O-])([O-])=O))}}
−
{{#set: molecular weight=317.447   }}
+
{{#set: common name=lipid IVA}}
−
{{#set: common name=leukotriene A(4)|(7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate|LTA4}}
+
{{#set: inchi key=InChIKey=KVJWZTLXIROHIL-QDORLFPLSA-J}}
−
{{#set: consumed by=LEUKOTRIENE-A4-HYDROLASE-RXN}}
+
{{#set: molecular weight=1401.69   }}
 +
{{#set: common name=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}}
 +
{{#set: consumed by=KDOTRANS-RXN}}
 +
{{#set: produced by=TETRAACYLDISACC4KIN-RXN}}

Latest revision as of 19:52, 21 March 2018

Metabolite LIPID-IV-A

  • 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)CO)OP([O-])([O-])=O))
  • common name:
    • lipid IVA
  • inchi key:
    • InChIKey=KVJWZTLXIROHIL-QDORLFPLSA-J
  • molecular weight:
    • 1401.69
  • Synonym(s):
    • 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

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)CO)OP([O-])([O-])=O))" cannot be used as a page name in this wiki.


"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.


Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=LIPID-IV-A&oldid=44361"