Difference between revisions of "DESMOSTEROL-CPD"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DESMOSTEROL-CPD DESMOSTEROL-CPD] == * smiles: ** CC(C)=CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2C...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(C)=CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2CC=C4(C(C)3CCC(O)C4)))) | ** CC(C)=CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2CC=C4(C(C)3CCC(O)C4)))) | ||
| + | * molecular weight: | ||
| + | ** 384.644 | ||
* inchi key: | * inchi key: | ||
** InChIKey=AVSXSVCZWQODGV-DPAQBDIFSA-N | ** InChIKey=AVSXSVCZWQODGV-DPAQBDIFSA-N | ||
* common name: | * common name: | ||
** desmosterol | ** desmosterol | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
** 24-dehydrocholesterol | ** 24-dehydrocholesterol | ||
| Line 16: | Line 16: | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
* [[RXN66-28]] | * [[RXN66-28]] | ||
| + | * [[extended_2.1.1.143-RXN_DESMOSTEROL-CPD]] | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
* [[RXN66-27]] | * [[RXN66-27]] | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| + | * METABOLIGHTS : MTBLC17737 | ||
* CAS : 313-04-2 | * CAS : 313-04-2 | ||
| − | |||
| − | |||
| − | |||
* HMDB : HMDB02719 | * HMDB : HMDB02719 | ||
| − | * | + | * LIPID_MAPS : LMST01010016 |
| − | + | ||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.388662.html 388662] | ** [http://www.chemspider.com/Chemical-Structure.388662.html 388662] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17737 17737] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17737 17737] | ||
| − | * | + | * LIGAND-CPD: |
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C01802 C01802] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=439577 439577] | ||
{{#set: smiles=CC(C)=CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2CC=C4(C(C)3CCC(O)C4))))}} | {{#set: smiles=CC(C)=CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2CC=C4(C(C)3CCC(O)C4))))}} | ||
| + | {{#set: molecular weight=384.644 }} | ||
{{#set: inchi key=InChIKey=AVSXSVCZWQODGV-DPAQBDIFSA-N}} | {{#set: inchi key=InChIKey=AVSXSVCZWQODGV-DPAQBDIFSA-N}} | ||
{{#set: common name=desmosterol}} | {{#set: common name=desmosterol}} | ||
| − | |||
{{#set: common name=24-dehydrocholesterol|Δ5,24-cholestadien-3-β-ol|desmesterol}} | {{#set: common name=24-dehydrocholesterol|Δ5,24-cholestadien-3-β-ol|desmesterol}} | ||
| − | {{#set: consumed by=RXN66-28}} | + | {{#set: consumed by=RXN66-28|extended_2.1.1.143-RXN_DESMOSTEROL-CPD}} |
{{#set: produced by=RXN66-27}} | {{#set: produced by=RXN66-27}} | ||
Latest revision as of 18:04, 9 January 2019
Contents
Metabolite DESMOSTEROL-CPD
- smiles:
- CC(C)=CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2CC=C4(C(C)3CCC(O)C4))))
- molecular weight:
- 384.644
- inchi key:
- InChIKey=AVSXSVCZWQODGV-DPAQBDIFSA-N
- common name:
- desmosterol
- Synonym(s):
- 24-dehydrocholesterol
- Δ5,24-cholestadien-3-β-ol
- desmesterol
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- METABOLIGHTS : MTBLC17737
- CAS : 313-04-2
- HMDB : HMDB02719
- LIPID_MAPS : LMST01010016
- CHEMSPIDER:
- CHEBI:
- LIGAND-CPD:
- PUBCHEM:
"CC(C)=CCCC(C)[CH]1(CC[CH]2(C(C)1CC[CH]3([CH]2CC=C4(C(C)3CCC(O)C4))))" cannot be used as a page name in this wiki.
