Difference between revisions of "R07562"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2232 CPD0-2232] == * smiles: ** CCCCCCCCCCCCCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-ACETYL-5-METHOXY-TRYPTAMINE N-ACETYL-5-METHOXY-TRYPTAMINE] == * smiles: ** CC(=O)NCCC2(=CNC1(...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD0-2232 CPD0-2232] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-ACETYL-5-METHOXY-TRYPTAMINE N-ACETYL-5-METHOXY-TRYPTAMINE] ==
 
* smiles:
 
* smiles:
−
** CCCCCCCCCCCCCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C(C1OP([O-])([O-])=O)O)N3(C=NC2(C(=NC=NC=23)N))))([O-])=O)(C)C)O)=O)=O)=O)O
+
** CC(=O)NCCC2(=CNC1(=C(C=C(OC)C=C1)2))
 
* inchi key:
 
* inchi key:
−
** InChIKey=DEHLMTDDPWDRDR-QQOJFMBSSA-J
+
** InChIKey=DRLFMBDRBRZALE-UHFFFAOYSA-N
 
* common name:
 
* common name:
−
** (S)-3-hydroxyhexadecanoyl-CoA
+
** melatonin
 
* molecular weight:
 
* molecular weight:
−
** 1017.914    
+
** 232.282    
 
* Synonym(s):
 
* Synonym(s):
−
** 3S-hydroxyhexadecanoyl-AoA
+
** N-acetyl-5-methoxy-tryptamine
−
** (S)-3-hydroxypalmitoyl-CoA
+
** N-[2-(5-methoxyindol-3-yl)ethyl]acetamide
 +
** 5-methoxy-N-acetyltryptamine
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-14271]]
+
* [[RXN-11057]]
 +
* [[RXN-11056]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 73-31-4
 +
* DRUGBANK : DB01065
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=896 896]
 +
* HMDB : HMDB01389
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C05258 C05258]
+
** [http://www.genome.jp/dbget-bin/www_bget?C01598 C01598]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.872.html 872]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62613 62613]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16796 16796]
−
* BIGG : 3hhdcoa
+
* METABOLIGHTS : MTBLC16796
−
* PUBCHEM:
+
{{#set: smiles=CC(=O)NCCC2(=CNC1(=C(C=C(OC)C=C1)2))}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=49859614 49859614]
+
{{#set: inchi key=InChIKey=DRLFMBDRBRZALE-UHFFFAOYSA-N}}
−
* HMDB : HMDB03932
+
{{#set: common name=melatonin}}
−
{{#set: smiles=CCCCCCCCCCCCCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C(C1OP([O-])([O-])=O)O)N3(C=NC2(C(=NC=NC=23)N))))([O-])=O)(C)C)O)=O)=O)=O)O}}
+
{{#set: molecular weight=232.282   }}
−
{{#set: inchi key=InChIKey=DEHLMTDDPWDRDR-QQOJFMBSSA-J}}
+
{{#set: common name=N-acetyl-5-methoxy-tryptamine|N-[2-(5-methoxyindol-3-yl)ethyl]acetamide|5-methoxy-N-acetyltryptamine}}
−
{{#set: common name=(S)-3-hydroxyhexadecanoyl-CoA}}
+
{{#set: consumed by=RXN-11057|RXN-11056}}
−
{{#set: molecular weight=1017.914   }}
+
−
{{#set: common name=3S-hydroxyhexadecanoyl-AoA|(S)-3-hydroxypalmitoyl-CoA}}
+
−
{{#set: consumed by=RXN-14271}}
+

Revision as of 17:35, 10 January 2018

Metabolite N-ACETYL-5-METHOXY-TRYPTAMINE

  • smiles:
    • CC(=O)NCCC2(=CNC1(=C(C=C(OC)C=C1)2))
  • inchi key:
    • InChIKey=DRLFMBDRBRZALE-UHFFFAOYSA-N
  • common name:
    • melatonin
  • molecular weight:
    • 232.282
  • Synonym(s):
    • N-acetyl-5-methoxy-tryptamine
    • N-[2-(5-methoxyindol-3-yl)ethyl]acetamide
    • 5-methoxy-N-acetyltryptamine

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 73-31-4
  • DRUGBANK : DB01065
  • PUBCHEM:
  • HMDB : HMDB01389
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16796



"N-[2-(5-methoxyindol-3-yl)ethyl]acetamide" cannot be used as a page name in this wiki.
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