Difference between revisions of "INDOLEYL-CPD"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12904 CPD-12904] == * smiles: ** CC(C)=CC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=INDOLEYL-CPD INDOLEYL-CPD] == * smiles: ** C2(NC1(C=CC=CC=1C(CC#N)=2)) * inchi key: ** InChIKey...") |
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| Line 1: | Line 1: | ||
[[Category:Metabolite]] | [[Category:Metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=INDOLEYL-CPD INDOLEYL-CPD] == |
* smiles: | * smiles: | ||
| − | ** | + | ** C2(NC1(C=CC=CC=1C(CC#N)=2)) |
* inchi key: | * inchi key: | ||
| − | ** InChIKey= | + | ** InChIKey=DMCPFOBLJMLSNX-UHFFFAOYSA-N |
* common name: | * common name: | ||
| − | ** | + | ** indole-3-acetonitrile |
* molecular weight: | * molecular weight: | ||
| − | ** | + | ** 156.187 |
* Synonym(s): | * Synonym(s): | ||
| + | ** IAN | ||
| + | ** indole-3-ylacetonitrile | ||
| + | ** 3-indoleacetonitrile | ||
| + | ** (indole-3-yl)acetonitrile | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | * [[RXN- | + | * [[RXN-1404]] |
== 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 == | ||
* PUBCHEM: | * PUBCHEM: | ||
| − | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid= | + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=351795 351795] |
| + | * KNAPSACK : C00000107 | ||
| + | * HMDB : HMDB06524 | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
| − | ** [http://www.genome.jp/dbget-bin/www_bget? | + | ** [http://www.genome.jp/dbget-bin/www_bget?C02938 C02938] |
| − | {{#set: smiles= | + | * CHEMSPIDER: |
| − | {{#set: inchi key=InChIKey= | + | ** [http://www.chemspider.com/Chemical-Structure.312357.html 312357] |
| − | {{#set: common name= | + | * CHEBI: |
| − | {{#set: molecular weight= | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17566 17566] |
| − | {{#set: consumed by=RXN- | + | * METABOLIGHTS : MTBLC17566 |
| + | {{#set: smiles=C2(NC1(C=CC=CC=1C(CC#N)=2))}} | ||
| + | {{#set: inchi key=InChIKey=DMCPFOBLJMLSNX-UHFFFAOYSA-N}} | ||
| + | {{#set: common name=indole-3-acetonitrile}} | ||
| + | {{#set: molecular weight=156.187 }} | ||
| + | {{#set: common name=IAN|indole-3-ylacetonitrile|3-indoleacetonitrile|(indole-3-yl)acetonitrile}} | ||
| + | {{#set: consumed by=RXN-1404}} | ||
Latest revision as of 19:20, 21 March 2018
Contents
Metabolite INDOLEYL-CPD
- smiles:
- C2(NC1(C=CC=CC=1C(CC#N)=2))
- inchi key:
- InChIKey=DMCPFOBLJMLSNX-UHFFFAOYSA-N
- common name:
- indole-3-acetonitrile
- molecular weight:
- 156.187
- Synonym(s):
- IAN
- indole-3-ylacetonitrile
- 3-indoleacetonitrile
- (indole-3-yl)acetonitrile
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
- KNAPSACK : C00000107
- HMDB : HMDB06524
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- METABOLIGHTS : MTBLC17566
