Difference between revisions of "CPD1G-1345"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-1345 CPD1G-1345] == * smiles: ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(...") |
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* smiles: | * smiles: | ||
** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3) | ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 1578.544 | ** 1578.544 | ||
| + | * inchi key: | ||
| + | ** InChIKey=BRQKYADGWZGFAR-ZVNWTMLTSA-N | ||
| + | * common name: | ||
| + | ** trehalose-cis-methoxy-mono-mycolate | ||
* Synonym(s): | * Synonym(s): | ||
| Line 19: | Line 19: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657560 90657560] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657560 90657560] | ||
{{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)}} | {{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=1578.544 }} | {{#set: molecular weight=1578.544 }} | ||
| + | {{#set: inchi key=InChIKey=BRQKYADGWZGFAR-ZVNWTMLTSA-N}} | ||
| + | {{#set: common name=trehalose-cis-methoxy-mono-mycolate}} | ||
{{#set: produced by=RXN1G-1436}} | {{#set: produced by=RXN1G-1436}} | ||
Latest revision as of 13:05, 10 January 2019
Contents
Metabolite CPD1G-1345
- smiles:
- CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)
- molecular weight:
- 1578.544
- inchi key:
- InChIKey=BRQKYADGWZGFAR-ZVNWTMLTSA-N
- common name:
- trehalose-cis-methoxy-mono-mycolate
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
