Difference between revisions of "CPD-7222"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7222 CPD-7222] == * smiles: ** CCCCCCCCCC=CC(SCCNC(CCNC(C(C(COP(OP(OCC3(OC(N2(C1(=C(C(=NC=N...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CCCCCCCCCC=CC(SCCNC(CCNC(C(C(COP(OP(OCC3(OC(N2(C1(=C(C(=NC=N1)N)N=C2)))C(C3OP([O-])([O-])=O)O))([O-])=O)([O-])=O)(C)C)O)=O)=O)=O | ** CCCCCCCCCC=CC(SCCNC(CCNC(C(C(COP(OP(OCC3(OC(N2(C1(=C(C(=NC=N1)N)N=C2)))C(C3OP([O-])([O-])=O)O))([O-])=O)([O-])=O)(C)C)O)=O)=O)=O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 943.792 | ** 943.792 | ||
| + | * inchi key: | ||
| + | ** InChIKey=IRFYVBULXZMEDE-XCFIPPSPSA-J | ||
| + | * common name: | ||
| + | ** (2E)-dodec-2-enoyl-CoA | ||
* Synonym(s): | * Synonym(s): | ||
** (2E)-dodecenoyl-CoA | ** (2E)-dodecenoyl-CoA | ||
** 2-trans-dodecenoyl-CoA | ** 2-trans-dodecenoyl-CoA | ||
| − | ** | + | ** trans-dodec-2-enoyl-CoA |
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| Line 18: | Line 18: | ||
* [[ACOA120OR]] | * [[ACOA120OR]] | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | |||
| − | |||
| − | |||
* [[ECOAH5m]] | * [[ECOAH5m]] | ||
| + | * [[ECOAH5]] | ||
* [[RXN-14262]] | * [[RXN-14262]] | ||
| + | * [[ECOAH5h]] | ||
| + | * [[RXN-7931]] | ||
== External links == | == External links == | ||
| − | |||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245396 25245396] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245396 25245396] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57330 57330] | ||
* HMDB : HMDB03712 | * HMDB : HMDB03712 | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C03221 C03221] | ** [http://www.genome.jp/dbget-bin/www_bget?C03221 C03221] | ||
| − | |||
| − | |||
* METABOLIGHTS : MTBLC57330 | * METABOLIGHTS : MTBLC57330 | ||
| + | * BIGG : dd2coa | ||
{{#set: smiles=CCCCCCCCCC=CC(SCCNC(CCNC(C(C(COP(OP(OCC3(OC(N2(C1(=C(C(=NC=N1)N)N=C2)))C(C3OP([O-])([O-])=O)O))([O-])=O)([O-])=O)(C)C)O)=O)=O)=O}} | {{#set: smiles=CCCCCCCCCC=CC(SCCNC(CCNC(C(C(COP(OP(OCC3(OC(N2(C1(=C(C(=NC=N1)N)N=C2)))C(C3OP([O-])([O-])=O)O))([O-])=O)([O-])=O)(C)C)O)=O)=O)=O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=943.792 }} | {{#set: molecular weight=943.792 }} | ||
| − | {{#set: common name=(2E)-dodecenoyl-CoA|2-trans-dodecenoyl-CoA| | + | {{#set: inchi key=InChIKey=IRFYVBULXZMEDE-XCFIPPSPSA-J}} |
| + | {{#set: common name=(2E)-dodec-2-enoyl-CoA}} | ||
| + | {{#set: common name=(2E)-dodecenoyl-CoA|2-trans-dodecenoyl-CoA|trans-dodec-2-enoyl-CoA}} | ||
{{#set: produced by=ACOA120OR}} | {{#set: produced by=ACOA120OR}} | ||
| − | {{#set: reversible reaction associated= | + | {{#set: reversible reaction associated=ECOAH5m|ECOAH5|RXN-14262|ECOAH5h|RXN-7931}} |
Latest revision as of 13:46, 10 January 2019
Contents
Metabolite CPD-7222
- smiles:
- CCCCCCCCCC=CC(SCCNC(CCNC(C(C(COP(OP(OCC3(OC(N2(C1(=C(C(=NC=N1)N)N=C2)))C(C3OP([O-])([O-])=O)O))([O-])=O)([O-])=O)(C)C)O)=O)=O)=O
- molecular weight:
- 943.792
- inchi key:
- InChIKey=IRFYVBULXZMEDE-XCFIPPSPSA-J
- common name:
- (2E)-dodec-2-enoyl-CoA
- Synonym(s):
- (2E)-dodecenoyl-CoA
- 2-trans-dodecenoyl-CoA
- trans-dodec-2-enoyl-CoA
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
- CHEBI:
- HMDB : HMDB03712
- LIGAND-CPD:
- METABOLIGHTS : MTBLC57330
- BIGG : dd2coa
"CCCCCCCCCC=CC(SCCNC(CCNC(C(C(COP(OP(OCC3(OC(N2(C1(=C(C(=NC=N1)N)N=C2)))C(C3OP([O-])([O-])=O)O))([O-])=O)([O-])=O)(C)C)O)=O)=O)=O" cannot be used as a page name in this wiki.
