Difference between revisions of "SECOLOGANIN-CPD"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SECOLOGANIN-CPD SECOLOGANIN-CPD] == * smiles: ** C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2)) | ** C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2)) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 388.371 | ** 388.371 | ||
| + | * inchi key: | ||
| + | ** InChIKey=CSKKDSFETGLMSB-NRZPKYKESA-N | ||
| + | * common name: | ||
| + | ** secologanin | ||
* Synonym(s): | * Synonym(s): | ||
** (-)-secologanin | ** (-)-secologanin | ||
| Line 17: | Line 17: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.141670.html 141670] | ||
| + | * REFMET : Secologanin | ||
* LIPID_MAPS : LMPR0102070002 | * LIPID_MAPS : LMPR0102070002 | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=161276 161276] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=161276 161276] | ||
| − | |||
| − | |||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18002 18002] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18002 18002] | ||
| Line 27: | Line 28: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C01852 C01852] | ** [http://www.genome.jp/dbget-bin/www_bget?C01852 C01852] | ||
{{#set: smiles=C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))}} | {{#set: smiles=C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))}} | ||
| − | |||
| − | |||
{{#set: molecular weight=388.371 }} | {{#set: molecular weight=388.371 }} | ||
| + | {{#set: inchi key=InChIKey=CSKKDSFETGLMSB-NRZPKYKESA-N}} | ||
| + | {{#set: common name=secologanin}} | ||
{{#set: common name=(-)-secologanin}} | {{#set: common name=(-)-secologanin}} | ||
{{#set: consumed by=STRICTOSIDINE-SYNTHASE-RXN}} | {{#set: consumed by=STRICTOSIDINE-SYNTHASE-RXN}} | ||
Latest revision as of 14:43, 10 January 2019
Contents
Metabolite SECOLOGANIN-CPD
- smiles:
- C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))
- molecular weight:
- 388.371
- inchi key:
- InChIKey=CSKKDSFETGLMSB-NRZPKYKESA-N
- common name:
- secologanin
- Synonym(s):
- (-)-secologanin
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- REFMET : Secologanin
- LIPID_MAPS : LMPR0102070002
- PUBCHEM:
- CHEBI:
- LIGAND-CPD:
"C=C[CH]1(C(OC=C(C(=O)OC)[CH](CC=O)1)OC2(OC(CO)C(O)C(O)C(O)2))" cannot be used as a page name in this wiki.
