Difference between revisions of "CPD-11398"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11398 CPD-11398] == * smiles: ** C(=O)([O-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=C(I)C(OC2(OC(...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(=O)([O-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=C(I)C(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))=C(I)C=3)) | ** C(=O)([O-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=C(I)C(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))=C(I)C=3)) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 951.992 | ** 951.992 | ||
| + | * inchi key: | ||
| + | ** InChIKey=RGHRJBIKIYUHEV-SGPDEFQSSA-M | ||
| + | * common name: | ||
| + | ** L-thyroxine phenolic β-D-glucuronide | ||
* Synonym(s): | * Synonym(s): | ||
** L-thyroxine phenolic glucuronide | ** L-thyroxine phenolic glucuronide | ||
| Line 23: | Line 23: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44237176 44237176] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44237176 44237176] | ||
{{#set: smiles=C(=O)([O-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=C(I)C(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))=C(I)C=3))}} | {{#set: smiles=C(=O)([O-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=C(I)C(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))=C(I)C=3))}} | ||
| − | |||
| − | |||
{{#set: molecular weight=951.992 }} | {{#set: molecular weight=951.992 }} | ||
| + | {{#set: inchi key=InChIKey=RGHRJBIKIYUHEV-SGPDEFQSSA-M}} | ||
| + | {{#set: common name=L-thyroxine phenolic β-D-glucuronide}} | ||
{{#set: common name=L-thyroxine phenolic glucuronide|thyroxine glucuronide|beta-D-glucopyranosiduronic acid, 4-(4-(2-amino-2-carboxyethyl)-2,6-diiodophenoxy)-2,6-diiodophenyl, (S)-|T4G}} | {{#set: common name=L-thyroxine phenolic glucuronide|thyroxine glucuronide|beta-D-glucopyranosiduronic acid, 4-(4-(2-amino-2-carboxyethyl)-2,6-diiodophenoxy)-2,6-diiodophenyl, (S)-|T4G}} | ||
{{#set: produced by=RXN-10606}} | {{#set: produced by=RXN-10606}} | ||
Latest revision as of 14:03, 10 January 2019
Contents
Metabolite CPD-11398
- smiles:
- C(=O)([O-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=C(I)C(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))=C(I)C=3))
- molecular weight:
- 951.992
- inchi key:
- InChIKey=RGHRJBIKIYUHEV-SGPDEFQSSA-M
- common name:
- L-thyroxine phenolic β-D-glucuronide
- Synonym(s):
- L-thyroxine phenolic glucuronide
- thyroxine glucuronide
- beta-D-glucopyranosiduronic acid, 4-(4-(2-amino-2-carboxyethyl)-2,6-diiodophenoxy)-2,6-diiodophenyl, (S)-
- T4G
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-])C([N+])CC1(=CC(I)=C(C(I)=C1)OC3(C=C(I)C(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))=C(I)C=3))" cannot be used as a page name in this wiki.
