Difference between revisions of "CPD1F-4"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-4 CPD1F-4] == * smiles: ** CC(=CC=CC=C(C)C=O)C=CC=C(C)C=C=C1(C(O)(C)CC(O)CC(C)(C)1) * inc...") |
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[[Category:Metabolite]] | [[Category:Metabolite]] | ||
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-4 CPD1F-4] == | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-4 CPD1F-4] == | ||
| + | * molecular weight: | ||
| + | ** 382.542 | ||
* smiles: | * smiles: | ||
** CC(=CC=CC=C(C)C=O)C=CC=C(C)C=C=C1(C(O)(C)CC(O)CC(C)(C)1) | ** CC(=CC=CC=C(C)C=O)C=CC=C(C)C=C=C1(C(O)(C)CC(O)CC(C)(C)1) | ||
| Line 7: | Line 9: | ||
* common name: | * common name: | ||
** (3S,5R,6R)-3,5-dihydroxy-6,7-didehydro-5,6-dihydro-12'-apo-β-caroten-12'-al | ** (3S,5R,6R)-3,5-dihydroxy-6,7-didehydro-5,6-dihydro-12'-apo-β-caroten-12'-al | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** C25-allenic-apo-aldehyde | ** C25-allenic-apo-aldehyde | ||
| Line 17: | Line 17: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=34596 34596] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=34596 34596] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245424 25245424] | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C14044 C14044] | ** [http://www.genome.jp/dbget-bin/www_bget?C14044 C14044] | ||
| + | {{#set: molecular weight=382.542 }} | ||
{{#set: smiles=CC(=CC=CC=C(C)C=O)C=CC=C(C)C=C=C1(C(O)(C)CC(O)CC(C)(C)1)}} | {{#set: smiles=CC(=CC=CC=C(C)C=O)C=CC=C(C)C=C=C1(C(O)(C)CC(O)CC(C)(C)1)}} | ||
{{#set: inchi key=InChIKey=MFDUGTOOXGORRX-ORGLZDQCSA-N}} | {{#set: inchi key=InChIKey=MFDUGTOOXGORRX-ORGLZDQCSA-N}} | ||
{{#set: common name=(3S,5R,6R)-3,5-dihydroxy-6,7-didehydro-5,6-dihydro-12'-apo-β-caroten-12'-al}} | {{#set: common name=(3S,5R,6R)-3,5-dihydroxy-6,7-didehydro-5,6-dihydro-12'-apo-β-caroten-12'-al}} | ||
| − | |||
{{#set: common name=C25-allenic-apo-aldehyde}} | {{#set: common name=C25-allenic-apo-aldehyde}} | ||
{{#set: produced by=RXN-698}} | {{#set: produced by=RXN-698}} | ||
Latest revision as of 13:19, 10 January 2019
Contents
Metabolite CPD1F-4
- molecular weight:
- 382.542
- smiles:
- CC(=CC=CC=C(C)C=O)C=CC=C(C)C=C=C1(C(O)(C)CC(O)CC(C)(C)1)
- inchi key:
- InChIKey=MFDUGTOOXGORRX-ORGLZDQCSA-N
- common name:
- (3S,5R,6R)-3,5-dihydroxy-6,7-didehydro-5,6-dihydro-12'-apo-β-caroten-12'-al
- Synonym(s):
- C25-allenic-apo-aldehyde
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
