Difference between revisions of "CPD1G-1353"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-1353 CPD1G-1353] == * smiles: ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-1353 CPD1G-1353] == * smiles: ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3) | ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3) | ||
| − | |||
| − | |||
* common name: | * common name: | ||
** trehalose-cis-keto-mono-mycolate | ** trehalose-cis-keto-mono-mycolate | ||
| + | * inchi key: | ||
| + | ** InChIKey=WPVQFTORCFMMCP-WBSUMZSHSA-N | ||
* molecular weight: | * molecular weight: | ||
** 1590.555 | ** 1590.555 | ||
| Line 19: | Line 19: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657448 90657448] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657448 90657448] | ||
{{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3)}} | {{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3)}} | ||
| − | |||
{{#set: common name=trehalose-cis-keto-mono-mycolate}} | {{#set: common name=trehalose-cis-keto-mono-mycolate}} | ||
| + | {{#set: inchi key=InChIKey=WPVQFTORCFMMCP-WBSUMZSHSA-N}} | ||
{{#set: molecular weight=1590.555 }} | {{#set: molecular weight=1590.555 }} | ||
{{#set: produced by=RXN1G-1438}} | {{#set: produced by=RXN1G-1438}} | ||
Latest revision as of 20:16, 21 March 2018
Contents
Metabolite CPD1G-1353
- smiles:
- CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3)
- common name:
- trehalose-cis-keto-mono-mycolate
- inchi key:
- InChIKey=WPVQFTORCFMMCP-WBSUMZSHSA-N
- molecular weight:
- 1590.555
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
