Difference between revisions of "CPD-590"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-590 CPD-590] == * smiles: ** C3(C(C2(OC1(C=C(C=C(C=1C(C2O)O)O)O)))=CC(O)=C(C=3)O) * inchi k...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C3(C(C2(OC1(C=C(C=C(C=1C(C2O)O)O)O)))=CC(O)=C(C=3)O) | ** C3(C(C2(OC1(C=C(C=C(C=1C(C2O)O)O)O)))=CC(O)=C(C=3)O) | ||
| + | * molecular weight: | ||
| + | ** 306.271 | ||
* inchi key: | * inchi key: | ||
** InChIKey=SBZWTSHAFILOTE-SOUVJXGZSA-N | ** InChIKey=SBZWTSHAFILOTE-SOUVJXGZSA-N | ||
* common name: | * common name: | ||
** (2R,3S,4S)-leucocyanidin | ** (2R,3S,4S)-leucocyanidin | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** 2,3-trans-3,4-cis-leucocyanidin | ** 2,3-trans-3,4-cis-leucocyanidin | ||
| 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=11412 11412] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=11412 11412] | ||
* METABOLIGHTS : MTBLC11412 | * METABOLIGHTS : MTBLC11412 | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=440833 440833] | ||
* LIGAND-CPD: | * LIGAND-CPD: | ||
** [http://www.genome.jp/dbget-bin/www_bget?C05906 C05906] | ** [http://www.genome.jp/dbget-bin/www_bget?C05906 C05906] | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.389677.html 389677] | ||
{{#set: smiles=C3(C(C2(OC1(C=C(C=C(C=1C(C2O)O)O)O)))=CC(O)=C(C=3)O)}} | {{#set: smiles=C3(C(C2(OC1(C=C(C=C(C=1C(C2O)O)O)O)))=CC(O)=C(C=3)O)}} | ||
| + | {{#set: molecular weight=306.271 }} | ||
{{#set: inchi key=InChIKey=SBZWTSHAFILOTE-SOUVJXGZSA-N}} | {{#set: inchi key=InChIKey=SBZWTSHAFILOTE-SOUVJXGZSA-N}} | ||
{{#set: common name=(2R,3S,4S)-leucocyanidin}} | {{#set: common name=(2R,3S,4S)-leucocyanidin}} | ||
| − | |||
{{#set: common name=2,3-trans-3,4-cis-leucocyanidin}} | {{#set: common name=2,3-trans-3,4-cis-leucocyanidin}} | ||
{{#set: produced by=RXN-600}} | {{#set: produced by=RXN-600}} | ||
Latest revision as of 16:01, 9 January 2019
Contents
Metabolite CPD-590
- smiles:
- C3(C(C2(OC1(C=C(C=C(C=1C(C2O)O)O)O)))=CC(O)=C(C=3)O)
- molecular weight:
- 306.271
- inchi key:
- InChIKey=SBZWTSHAFILOTE-SOUVJXGZSA-N
- common name:
- (2R,3S,4S)-leucocyanidin
- Synonym(s):
- 2,3-trans-3,4-cis-leucocyanidin
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
