Difference between revisions of "CPD-4125"

Latest revision as of 15:12, 9 January 2019

smiles:
- CC=C(C(C)C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))
molecular weight:
- 412.698
inchi key:
- InChIKey=MCWVPSBQQXUCTB-OQTIOYDCSA-N
common name:
- avenasterol
Synonym(s):

"CC=C(C(C)C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))" cannot be used as a page name in this wiki.

@@ Line 1: / Line 1: @@
 [[Category:Metabolite]]
-== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=Chalcones Chalcones] ==
+== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4125 CPD-4125] ==
+* smiles:
+** CC=C(C(C)C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))
+* molecular weight:
+** 412.698
+* inchi key:
+** InChIKey=MCWVPSBQQXUCTB-OQTIOYDCSA-N
 * common name:
-** a chalcone
+** avenasterol
 * Synonym(s):
-** a chalconoid
 == Reaction(s) known to consume the compound ==
+* [[RXN-4209]]
 == Reaction(s) known to produce the compound ==
 == Reaction(s) of unknown directionality ==
-* [[CHALCONE-ISOMERASE-RXN]]
 == External links  ==
-{{#set: common name=a chalcone}}
+* PUBCHEM:
-{{#set: common name=a chalconoid}}
+** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=12795736 12795736]
-{{#set: consumed or produced by=CHALCONE-ISOMERASE-RXN}}
+* LIGAND-CPD:
+** [http://www.genome.jp/dbget-bin/www_bget?C15782 C15782]
+* HMDB : HMDB06851
+{{#set: smiles=CC=C(C(C)C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))}}
+{{#set: molecular weight=412.698    }}
+{{#set: inchi key=InChIKey=MCWVPSBQQXUCTB-OQTIOYDCSA-N}}
+{{#set: common name=avenasterol}}
+{{#set: consumed by=RXN-4209}}