Difference between revisions of "CPD-7280"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7280 CPD-7280] == * smiles: ** CC(C=CC=C(C)C=CC12(OC(CC(O)CC(C)(C)1)2))=CC=CC=C(C)CC=O * in...") |
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[[Category:Metabolite]] | [[Category:Metabolite]] | ||
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7280 CPD-7280] == | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7280 CPD-7280] == | ||
| + | * molecular weight: | ||
| + | ** 382.542 | ||
* smiles: | * smiles: | ||
** CC(C=CC=C(C)C=CC12(OC(CC(O)CC(C)(C)1)2))=CC=CC=C(C)CC=O | ** CC(C=CC=C(C)C=CC12(OC(CC(O)CC(C)(C)1)2))=CC=CC=C(C)CC=O | ||
| Line 7: | Line 9: | ||
* common name: | * common name: | ||
** (3S,5R,6S)-5,6-epoxy-3-hydroxy-5,6-dihydro-12'-apo-β-caroten-12'-al | ** (3S,5R,6S)-5,6-epoxy-3-hydroxy-5,6-dihydro-12'-apo-β-caroten-12'-al | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
| Line 18: | Line 18: | ||
* PUBCHEM: | * PUBCHEM: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25246021 25246021] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25246021 25246021] | ||
| + | {{#set: molecular weight=382.542 }} | ||
{{#set: smiles=CC(C=CC=C(C)C=CC12(OC(CC(O)CC(C)(C)1)2))=CC=CC=C(C)CC=O}} | {{#set: smiles=CC(C=CC=C(C)C=CC12(OC(CC(O)CC(C)(C)1)2))=CC=CC=C(C)CC=O}} | ||
{{#set: inchi key=InChIKey=FYYDCJDEFSYVOY-WENURHBKSA-N}} | {{#set: inchi key=InChIKey=FYYDCJDEFSYVOY-WENURHBKSA-N}} | ||
{{#set: common name=(3S,5R,6S)-5,6-epoxy-3-hydroxy-5,6-dihydro-12'-apo-β-caroten-12'-al}} | {{#set: common name=(3S,5R,6S)-5,6-epoxy-3-hydroxy-5,6-dihydro-12'-apo-β-caroten-12'-al}} | ||
| − | |||
{{#set: produced by=RXN-7973-CPD-7424/OXYGEN-MOLECULE//CPD-7279/CPD-7280.44.}} | {{#set: produced by=RXN-7973-CPD-7424/OXYGEN-MOLECULE//CPD-7279/CPD-7280.44.}} | ||
Latest revision as of 12:59, 10 January 2019
Contents
Metabolite CPD-7280
- molecular weight:
- 382.542
- smiles:
- CC(C=CC=C(C)C=CC12(OC(CC(O)CC(C)(C)1)2))=CC=CC=C(C)CC=O
- inchi key:
- InChIKey=FYYDCJDEFSYVOY-WENURHBKSA-N
- common name:
- (3S,5R,6S)-5,6-epoxy-3-hydroxy-5,6-dihydro-12'-apo-β-caroten-12'-al
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
