Difference between revisions of "COB-I-ALAMIN"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=COB-I-ALAMIN COB-I-ALAMIN] == * smiles: ** CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12)))) | ** CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12)))) | ||
| + | * molecular weight: | ||
| + | ** 1329.36 | ||
* inchi key: | * inchi key: | ||
** InChIKey=OMAOKVYASDIYQG-DSRCUDDDSA-L | ** InChIKey=OMAOKVYASDIYQG-DSRCUDDDSA-L | ||
* common name: | * common name: | ||
** cob(I)alamin | ** cob(I)alamin | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** cobalamin | ** cobalamin | ||
| Line 21: | Line 21: | ||
* [[ExchangeSeed_COB-I-ALAMIN]] | * [[ExchangeSeed_COB-I-ALAMIN]] | ||
== External links == | == External links == | ||
| − | |||
* METABOLIGHTS : MTBLC15982 | * METABOLIGHTS : MTBLC15982 | ||
| − | * | + | * BIGG : cbl1 |
| − | * | + | * CAS : 18534-66-2 |
* HMDB : HMDB03429 | * HMDB : HMDB03429 | ||
| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4573816.html 4573816] | ** [http://www.chemspider.com/Chemical-Structure.4573816.html 4573816] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15982 15982] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15982 15982] | ||
| − | * | + | * LIGAND-CPD: |
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00853 C00853] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460183 5460183] | ||
{{#set: smiles=CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12))))}} | {{#set: smiles=CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12))))}} | ||
| + | {{#set: molecular weight=1329.36 }} | ||
{{#set: inchi key=InChIKey=OMAOKVYASDIYQG-DSRCUDDDSA-L}} | {{#set: inchi key=InChIKey=OMAOKVYASDIYQG-DSRCUDDDSA-L}} | ||
{{#set: common name=cob(I)alamin}} | {{#set: common name=cob(I)alamin}} | ||
| − | |||
{{#set: common name=cobalamin|B12s}} | {{#set: common name=cobalamin|B12s}} | ||
{{#set: consumed by=TransportSeed_COB-I-ALAMIN|COBALADENOSYLTRANS-RXN}} | {{#set: consumed by=TransportSeed_COB-I-ALAMIN|COBALADENOSYLTRANS-RXN}} | ||
{{#set: produced by=TransportSeed_COB-I-ALAMIN}} | {{#set: produced by=TransportSeed_COB-I-ALAMIN}} | ||
{{#set: reversible reaction associated=ExchangeSeed_COB-I-ALAMIN}} | {{#set: reversible reaction associated=ExchangeSeed_COB-I-ALAMIN}} | ||
Latest revision as of 17:19, 9 January 2019
Contents
Metabolite COB-I-ALAMIN
- smiles:
- CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12))))
- molecular weight:
- 1329.36
- inchi key:
- InChIKey=OMAOKVYASDIYQG-DSRCUDDDSA-L
- common name:
- cob(I)alamin
- Synonym(s):
- cobalamin
- B12s
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC15982
- BIGG : cbl1
- CAS : 18534-66-2
- HMDB : HMDB03429
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
"CC%10(=C(C)C=C9(N8(C%12(OC(CO)C(OP([O-])(=O)OC(C)CNC(=O)CCC1(C)(C(CC(N)=O)[CH]%11(C7(C)(C(C)(CC(N)=O)C(CCC(=O)N)C6(C(C)=C5(C(CC(=O)N)(C)C(CCC(N)=O)C4(C=C3(C(C)(C)C(CCC(N)=O)C2(C(C)=C1N([Co----]([N+]=23)([N+]=45)([N+]=67)[N+](=C8)C9=C%10)%11)))))))))C(O)%12))))" cannot be used as a page name in this wiki.
