Difference between revisions of "CPD1G-1354"

Latest revision as of 11:15, 18 March 2021

common-name:
- trehalose-trans-keto-mono-mycolate
smiles:
- ccccccccccccccccccccccccccc(c(=o)occ2(c(o)c(o)c(o)c(oc1(c(o)c(o)c(o)c(co)o1))o2))c(o)ccccccccccccccccc3(cc3c(c)ccccccccccccccccc(=o)c(c)ccccccccccccccccc)
inchi-key:
- zhikieytxxjmog-uqwwgajesa-n
molecular-weight:
- 1590.555

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-7279 ==
+== Metabolite CPD1G-1354 ==
 * common-name:
-** 2-cis,4-trans-xanthoxin
+** trehalose-trans-keto-mono-mycolate
 * smiles:
-** cc(c=cc12(c(cc(cc1(c)o2)o)(c)c))=cc=o
+** ccccccccccccccccccccccccccc(c(=o)occ2(c(o)c(o)c(o)c(oc1(c(o)c(o)c(o)c(co)o1))o2))c(o)ccccccccccccccccc3(cc3c(c)ccccccccccccccccc(=o)c(c)ccccccccccccccccc)
 * inchi-key:
-** ztalkmxohwqnia-tvbshjcbsa-n
+** zhikieytxxjmog-uqwwgajesa-n
 * molecular-weight:
-** 250.337
+** 1590.555
 == Reaction(s) known to consume the compound ==
-* [[1.1.1.288-RXN]]
 == Reaction(s) known to produce the compound ==
-* [[RXN-698]]
+* [[RXN1G-1439]]
-* [[RXN-7973-CPD-7424/OXYGEN-MOLECULE//CPD-7279/CPD-7280.44.]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=2-cis,4-trans-xanthoxin}}
+{{#set: common-name=trehalose-trans-keto-mono-mycolate}}
-{{#set: inchi-key=inchikey=ztalkmxohwqnia-tvbshjcbsa-n}}
+{{#set: inchi-key=inchikey=zhikieytxxjmog-uqwwgajesa-n}}
-{{#set: molecular-weight=250.337}}
+{{#set: molecular-weight=1590.555}}