Difference between revisions of "ACP"

Revision as of 19:00, 17 March 2021

common-name:
- sitosterol
molecular-weight:
- 414.713
inchi-key:
- kzjwdpnrjallns-vjsfxxlfsa-n
smiles:
- ccc(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))

@@ Line 1: / Line 1: @@
 [[Category:metabolite]]
-== Metabolite CPD-13575 ==
+== Metabolite CPD-4143 ==
 * common-name:
-** 2-[(2r,5z)-2-carboxy-4-methylthiazol-5(2h)-ylidene]ethyl phosphate
+** sitosterol
 * molecular-weight:
-** 264.169
+** 414.713
 * inchi-key:
-** pqmcqnovnfnpfj-hyimlasbsa-k
+** kzjwdpnrjallns-vjsfxxlfsa-n
 * smiles:
-** cc1(c(=ccop([o-])(=o)[o-])sc(c(=o)[o-])n=1)
+** ccc(c(c)c)ccc(c)[ch]3(cc[ch]4([ch]2(cc=c1(cc(o)ccc(c)1[ch]2ccc(c)34))))
 == Reaction(s) known to consume the compound ==
-* [[RXN-12611]]
+* [[RXN-12128]]
+* [[RXN-12789]]
 == Reaction(s) known to produce the compound ==
+* [[RXN-12789]]
 == Reaction(s) of unknown directionality ==
-{{#set: common-name=2-[(2r,5z)-2-carboxy-4-methylthiazol-5(2h)-ylidene]ethyl phosphate}}
+{{#set: common-name=sitosterol}}
-{{#set: molecular-weight=264.169}}
+{{#set: molecular-weight=414.713}}
-{{#set: inchi-key=inchikey=pqmcqnovnfnpfj-hyimlasbsa-k}}
+{{#set: inchi-key=inchikey=kzjwdpnrjallns-vjsfxxlfsa-n}}