Difference between revisions of "THIAMINE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=THIAMINE THIAMINE] == * smiles: ** CC1([N+](=CSC(CCO)=1)CC2(C=NC(C)=NC(N)=2)) * inchi key: ** I...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC1([N+](=CSC(CCO)=1)CC2(C=NC(C)=NC(N)=2)) | ** CC1([N+](=CSC(CCO)=1)CC2(C=NC(C)=NC(N)=2)) | ||
| + | * molecular weight: | ||
| + | ** 265.352 | ||
* inchi key: | * inchi key: | ||
** InChIKey=JZRWCGZRTZMZEH-UHFFFAOYSA-N | ** InChIKey=JZRWCGZRTZMZEH-UHFFFAOYSA-N | ||
* common name: | * common name: | ||
** thiamine | ** thiamine | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** thiamin | ** thiamin | ||
| Line 14: | Line 14: | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| − | |||
* [[TransportSeed_THIAMINE]] | * [[TransportSeed_THIAMINE]] | ||
| + | * [[THIAMIN-PYROPHOSPHOKINASE-RXN]] | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
* [[TransportSeed_THIAMINE]] | * [[TransportSeed_THIAMINE]] | ||
| Line 21: | Line 21: | ||
* [[ExchangeSeed_THIAMINE]] | * [[ExchangeSeed_THIAMINE]] | ||
== External links == | == External links == | ||
| + | * METABOLIGHTS : MTBLC18385 | ||
* CAS : 67-03-8 | * CAS : 67-03-8 | ||
* CAS : 59-43-8 | * CAS : 59-43-8 | ||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C00378 C00378] | ** [http://www.genome.jp/dbget-bin/www_bget?C00378 C00378] | ||
| + | * HMDB : HMDB00235 | ||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.1098.html 1098] | ** [http://www.chemspider.com/Chemical-Structure.1098.html 1098] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18385 18385] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18385 18385] | ||
| + | * DRUGBANK : DB00152 | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1130 1130] | ||
* BIGG : thm | * BIGG : thm | ||
{{#set: smiles=CC1([N+](=CSC(CCO)=1)CC2(C=NC(C)=NC(N)=2))}} | {{#set: smiles=CC1([N+](=CSC(CCO)=1)CC2(C=NC(C)=NC(N)=2))}} | ||
| + | {{#set: molecular weight=265.352 }} | ||
{{#set: inchi key=InChIKey=JZRWCGZRTZMZEH-UHFFFAOYSA-N}} | {{#set: inchi key=InChIKey=JZRWCGZRTZMZEH-UHFFFAOYSA-N}} | ||
{{#set: common name=thiamine}} | {{#set: common name=thiamine}} | ||
| − | |||
{{#set: common name=thiamin|vitamin B1}} | {{#set: common name=thiamin|vitamin B1}} | ||
| − | {{#set: consumed by=THIAMIN-PYROPHOSPHOKINASE-RXN | + | {{#set: consumed by=TransportSeed_THIAMINE|THIAMIN-PYROPHOSPHOKINASE-RXN}} |
{{#set: produced by=TransportSeed_THIAMINE}} | {{#set: produced by=TransportSeed_THIAMINE}} | ||
{{#set: reversible reaction associated=ExchangeSeed_THIAMINE}} | {{#set: reversible reaction associated=ExchangeSeed_THIAMINE}} | ||
Latest revision as of 18:54, 9 January 2019
Contents
Metabolite THIAMINE
- smiles:
- CC1([N+](=CSC(CCO)=1)CC2(C=NC(C)=NC(N)=2))
- molecular weight:
- 265.352
- inchi key:
- InChIKey=JZRWCGZRTZMZEH-UHFFFAOYSA-N
- common name:
- thiamine
- Synonym(s):
- thiamin
- vitamin B1
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC18385
- CAS : 67-03-8
- CAS : 59-43-8
- LIGAND-CPD:
- HMDB : HMDB00235
- CHEMSPIDER:
- CHEBI:
- DRUGBANK : DB00152
- PUBCHEM:
- BIGG : thm
"CC1([N+](=CSC(CCO)=1)CC2(C=NC(C)=NC(N)=2))" cannot be used as a page name in this wiki.
