Difference between revisions of "CPD-12568"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12568 CPD-12568] == * smiles: ** C=CC(CCC=C(CCC=C(C)C)C)(C)O * common name: ** (3S,6E)-nero...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C=CC(CCC=C(CCC=C(C)C)C)(C)O | ** C=CC(CCC=C(CCC=C(C)C)C)(C)O | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 222.37 | ** 222.37 | ||
| + | * inchi key: | ||
| + | ** InChIKey=FQTLCLSUCSAZDY-ATGUSINASA-N | ||
| + | * common name: | ||
| + | ** (3S,6E)-nerolidol | ||
* Synonym(s): | * Synonym(s): | ||
** (3S)-(E)-nerolidol | ** (3S)-(E)-nerolidol | ||
| Line 18: | Line 18: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
| − | |||
* KNAPSACK : C00003166 | * KNAPSACK : C00003166 | ||
| − | |||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C09704 C09704] | ** [http://www.genome.jp/dbget-bin/www_bget?C09704 C09704] | ||
| + | * HMDB : HMDB41629 | ||
| + | * LIPID_MAPS : LMPR0103010005 | ||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.4444858.html 4444858] | ** [http://www.chemspider.com/Chemical-Structure.4444858.html 4444858] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=59958 59958] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=59958 59958] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5281525 5281525] | ||
{{#set: smiles=C=CC(CCC=C(CCC=C(C)C)C)(C)O}} | {{#set: smiles=C=CC(CCC=C(CCC=C(C)C)C)(C)O}} | ||
| − | |||
| − | |||
{{#set: molecular weight=222.37 }} | {{#set: molecular weight=222.37 }} | ||
| + | {{#set: inchi key=InChIKey=FQTLCLSUCSAZDY-ATGUSINASA-N}} | ||
| + | {{#set: common name=(3S,6E)-nerolidol}} | ||
{{#set: common name=(3S)-(E)-nerolidol}} | {{#set: common name=(3S)-(E)-nerolidol}} | ||
{{#set: consumed by=RXN-11911}} | {{#set: consumed by=RXN-11911}} | ||
{{#set: produced by=RXN-8616}} | {{#set: produced by=RXN-8616}} | ||
Latest revision as of 18:17, 9 January 2019
Contents
Metabolite CPD-12568
- smiles:
- C=CC(CCC=C(CCC=C(C)C)C)(C)O
- molecular weight:
- 222.37
- inchi key:
- InChIKey=FQTLCLSUCSAZDY-ATGUSINASA-N
- common name:
- (3S,6E)-nerolidol
- Synonym(s):
- (3S)-(E)-nerolidol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- KNAPSACK : C00003166
- LIGAND-CPD:
- HMDB : HMDB41629
- LIPID_MAPS : LMPR0103010005
- CHEMSPIDER:
- CHEBI:
- PUBCHEM:
