Difference between revisions of "CPD-11401"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11401 CPD-11401] == * smiles: ** C([O-])(=O)C1(OC(C(O)C(O)C(O)1)OC(=O)C(N)CC2(=CC(I)=C(C(I)...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C([O-])(=O)C1(OC(C(O)C(O)C(O)1)OC(=O)C(N)CC2(=CC(I)=C(C(I)=C2)OC3(=CC(I)=C(O)C(I)=C3))) | ** C([O-])(=O)C1(OC(C(O)C(O)C(O)1)OC(=O)C(N)CC2(=CC(I)=C(C(I)=C2)OC3(=CC(I)=C(O)C(I)=C3))) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 951.992 | ** 951.992 | ||
| + | * inchi key: | ||
| + | ** InChIKey=HMTFXPJOBPIOIN-DKBYMCRTSA-M | ||
| + | * common name: | ||
| + | ** L-thyroxine acyl β-D-glucuronide | ||
* Synonym(s): | * Synonym(s): | ||
| Line 19: | Line 19: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657991 90657991] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657991 90657991] | ||
{{#set: smiles=C([O-])(=O)C1(OC(C(O)C(O)C(O)1)OC(=O)C(N)CC2(=CC(I)=C(C(I)=C2)OC3(=CC(I)=C(O)C(I)=C3)))}} | {{#set: smiles=C([O-])(=O)C1(OC(C(O)C(O)C(O)1)OC(=O)C(N)CC2(=CC(I)=C(C(I)=C2)OC3(=CC(I)=C(O)C(I)=C3)))}} | ||
| − | |||
| − | |||
{{#set: molecular weight=951.992 }} | {{#set: molecular weight=951.992 }} | ||
| + | {{#set: inchi key=InChIKey=HMTFXPJOBPIOIN-DKBYMCRTSA-M}} | ||
| + | {{#set: common name=L-thyroxine acyl β-D-glucuronide}} | ||
{{#set: produced by=RXN-10608}} | {{#set: produced by=RXN-10608}} | ||
Latest revision as of 10:41, 10 January 2019
Contents
Metabolite CPD-11401
- smiles:
- C([O-])(=O)C1(OC(C(O)C(O)C(O)1)OC(=O)C(N)CC2(=CC(I)=C(C(I)=C2)OC3(=CC(I)=C(O)C(I)=C3)))
- molecular weight:
- 951.992
- inchi key:
- InChIKey=HMTFXPJOBPIOIN-DKBYMCRTSA-M
- common name:
- L-thyroxine acyl β-D-glucuronide
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
"C([O-])(=O)C1(OC(C(O)C(O)C(O)1)OC(=O)C(N)CC2(=CC(I)=C(C(I)=C2)OC3(=CC(I)=C(O)C(I)=C3)))" cannot be used as a page name in this wiki.
