Difference between revisions of "OCTANOL"

Revision as of 15:28, 5 January 2021

common-name:
- 1-16:0-2-18:3-digalactosyldiacylglycerol
smiles:
- ccc=ccc=ccc=ccccccccc(oc(coc2(oc(coc1(oc(co)c(o)c(o)c(o)1))c(o)c(o)c(o)2))coc(=o)ccccccccccccccc)=o
inchi-key:
- wvwinzzvfafvmj-hzdsjjkasa-n
molecular-weight:
- 915.209

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite THIAMINE ==
+== Metabolite CPD-8164 ==
 * common-name:
-** thiamine
+** 1-16:0-2-18:3-digalactosyldiacylglycerol
 * smiles:
-** cc1([n+](=csc(cco)=1)cc2(c=nc(c)=nc(n)=2))
+** ccc=ccc=ccc=ccccccccc(oc(coc2(oc(coc1(oc(co)c(o)c(o)c(o)1))c(o)c(o)c(o)2))coc(=o)ccccccccccccccc)=o
 * inchi-key:
-** jzrwcgzrtzmzeh-uhfffaoysa-n
+** wvwinzzvfafvmj-hzdsjjkasa-n
 * molecular-weight:
-** 265.352
+** 915.209
 == Reaction(s) known to consume the compound ==
-* [[ExchangeSeed-THIAMINE]]
-* [[THIAMIN-PYROPHOSPHOKINASE-RXN]]
-* [[THIAMINASE-RXN]]
-* [[TransportSeed-THIAMINE]]
 == Reaction(s) known to produce the compound ==
-* [[ExchangeSeed-THIAMINE]]
+* [[RXN-8365]]
-* [[TransportSeed-THIAMINE]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=thiamine}}
+{{#set: common-name=1-16:0-2-18:3-digalactosyldiacylglycerol}}
-{{#set: inchi-key=inchikey=jzrwcgzrtzmzeh-uhfffaoysa-n}}
+{{#set: inchi-key=inchikey=wvwinzzvfafvmj-hzdsjjkasa-n}}
-{{#set: molecular-weight=265.352}}
+{{#set: molecular-weight=915.209}}